[ CAS No. 1238617-40-7 ] {[proInfo.proName]}

Name: 1238617-40-7|2-(Pyridin-4-yl)terephthalic acid|95%
Brand: Ambeed
SKU: A1195843
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Structure of 1238617-40-7 * Storage: {[proInfo.prStorage]}

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Quality Control of [ 1238617-40-7 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 1238617-40-7 ]

SDS Specification

Alternatived Products of [ 1238617-40-7 ]

Product Details of [ 1238617-40-7 ]

CAS No. :	1238617-40-7	MDL No. :	MFCD34165634
Formula :	C₁₃H₉NO₄	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	HKLXQHZNQUNGEK-UHFFFAOYSA-N
M.W :	243.21	Pubchem ID :	141500566
Synonyms :

Safety of [ 1238617-40-7 ]

Signal Word:	Warning	Class:
Precautionary Statements:	P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313	UN#:
Hazard Statements:	H315-H319	Packing Group:
GHS Pictogram:

Application In Synthesis of [ 1238617-40-7 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Downstream synthetic route of [ 1238617-40-7 ]

[ 1238617-40-7 ] Synthesis Path-Downstream 1~22

1
[ 56643-83-5 ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
45%	With sodium hydroxide at 170℃; for 72h;

Reference： [1]Fan, Liming; Fan, Weiliu; Li, Bin; Liu, Xinzheng; Zhao, Xian; Zhang, Xiutang [RSC Advances, 2015, vol. 5, # 19, p. 14897 - 14905]

2
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 144693-25-4 ]
[ 1807751-16-1 ]

Yield	Reaction Conditions	Operation in experiment
41%	With sodium hydroxide In water at 170℃; for 72h;

Reference： [1]Fan, Liming; Fan, Weiliu; Li, Bin; Liu, Xinzheng; Zhao, Xian; Zhang, Xiutang [RSC Advances, 2015, vol. 5, # 19, p. 14897 - 14905]

3
[ 1347702-73-1 ]
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
59%	With sodium hydroxide In water at 170℃; for 72h;

Reference： [1]Fan, Liming; Fan, Weiliu; Li, Bin; Liu, Xinzheng; Zhao, Xian; Zhang, Xiutang [RSC Advances, 2015, vol. 5, # 19, p. 14897 - 14905]

4
zinc(II) sulfate heptahydrate [ No CAS ]
2-(4-pyridyl)-terephthalic acid [ No CAS ]
[ 69506-92-9 ]
[Zn(6-(4-pyridyl)terephthalate)(1,3-bis(imidazol-1-ylmethyl)benzene)_0.5]*1.5H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
63%	With sodium hydroxide In water at 170℃; for 72h;

Reference： [1]Fan, Liming; Fan, Weiliu; Li, Bin; Liu, Xinzheng; Zhao, Xian; Zhang, Xiutang [RSC Advances, 2015, vol. 5, # 19, p. 14897 - 14905]

5
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ 2417110-07-5 ]

Yield	Reaction Conditions	Operation in experiment
68%	Stage #1: zinc(II) nitrate hexahydrate; 2-(4-pyridyl)-terephthalic acid; water With sodium hydroxide at 20℃; for 0.5h; Stage #2: at 160℃; for 48h;

Reference： [1]Zhang, Jun; Huang, Yike; Yue, Dan; Cui, Yuanjing; Yang, Yu; Qian, Guodong [Journal of Materials Chemistry B, 2018, vol. 6, # 31, p. 5174 - 5180]

6
[ 872-50-4 ]
[ CAS Unavailable ]
[ 127-19-5 ]
[ 1238617-40-7 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
59%	at 20 - 90℃; for 80.3333h; Sealed tube;	Synthesis of WFU-1: A mixture of 2-(4-pyridyl)terephthalic acid (0.014mmol, 3.2mg), Co(NO3)2·6H2O(0.012 mmol, 3.6mg)and 0.15mL 0.1M HNO3 were dissolved in 0.85mL of mixed solvents of DMAC/NMP (v/v=8:9). After ultrasounding at room temperature for half an hour, the mixed solution was sealed in a pressure-resistant glass tube. Then, the glass tube was slowly heated to 90°C from room temperature in 500min, kept at 90°C for 4320min in an oven. After cooling down to room temperature in 1000min, violet rode like crystals were collected by filtration with the yield of 2.95mg, 59% (based on cobalt). Anal. Calc. (found) for C35 H37 Co2 N4 O12.50: C, 50.51 (50.34); H, 4.45 (4.51), N, 6.73 (6.86).

Reference： [1]Lu, Jitao; Wang, Suqing; Ding, Caifeng; Lv, Wei; Zeng, Yue; Liu, Nan; Wang, Huiqin; Meng, Qingguo; Liu, Qingyun [Journal of Alloys and Compounds, 2019, vol. 778, p. 134 - 140]

7
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 2417110-07-5 ]

Yield	Reaction Conditions	Operation in experiment
43%	With 4,4'-bipyridine In water at 160℃; for 72h; Autoclave;

Reference： [1]An, Fengqin; Zhang, Chengcheng; Duan, Lijuan; Liu, Xiangyu; Wang, Zheng; Jin, Xiaoyong; Song, Weiming [New Journal of Chemistry, 2019, vol. 43, # 12, p. 4800 - 4807]

8
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 2417110-09-7 ]

Yield	Reaction Conditions	Operation in experiment
60%	With 4,4'-bipyridine In water at 160℃; for 72h; Autoclave;

Reference： [1]An, Fengqin; Zhang, Chengcheng; Duan, Lijuan; Liu, Xiangyu; Wang, Zheng; Jin, Xiaoyong; Song, Weiming [New Journal of Chemistry, 2019, vol. 43, # 12, p. 4800 - 4807]

9
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
48%	In water at 160℃; for 72h; High pressure;	4.2 Synthesis of [Co(pta)(H2O)2]n (1) A mixture of H2pta (0.15 mmol, 0.0365 g), CoCl2 · 6H2O(0.15 mmol, 0.0357 g), and 6 mL H2O was heated at160°C for 3 days in a Teflon-lined stainless steel vesseland then cooled at a descent rate of 5 K h-1 to room temperature.Red block-like crystals of 1 were collected byfiltration. Yield 48% (based on Co). - Analysis calcd. forC13H11CoNO6 (M = 336.16): C 46.45, H 3.30, N 4.17; found C46.40, H 3.27, N 4.13%.

Reference： [1]Tian, Danian; Ding, Runmei; Chen, Bingbing; Cen, Peipei [Zeitschrift fur Naturforschung, B: Chemical Sciences, 2019, vol. 74, # 7-8, p. 619 - 622]

10
[ 855766-92-6 ]
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ 2416135-25-4 ]

Yield	Reaction Conditions	Operation in experiment
	In water at 160℃; for 72h; High pressure; Autoclave;

Reference： [1]Cui, Yuanjing; Yue, Dan; Huang, Yike; Zhang, Jun; Wang, Zhiyu; Yang, Deren; Qian, Guodong [Chemical Communications, 2019, vol. 55, # 75, p. 11231 - 11234]

11
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
58%	at 160℃; for 72h; High pressure;

Reference： [1]Cen, Peipei; Duan, Lijuan; Jin, Xiaoyong; Liang, Chen; Liu, Xiangyu; Yang, Jinhui; Zhang, Chengcheng [CrystEngComm, 2020, vol. 22, # 10, p. 1695 - 1704]

12
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
74%	at 160℃; for 72h; High pressure;

Reference： [1]Cen, Peipei; Duan, Lijuan; Jin, Xiaoyong; Liang, Chen; Liu, Xiangyu; Yang, Jinhui; Zhang, Chengcheng [CrystEngComm, 2020, vol. 22, # 10, p. 1695 - 1704]

13
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
55%	at 160℃; for 48h; Autoclave;

Reference： [1]Cen, Peipei; Ferrando-Soria, Jesús; Jin, Xiaoyong; Liu, Xiangyu; Ma, Xiufang; Pardo, Emilio; Yang, Jinhui; Zhang, Chengcheng; Zhang, Yi-Quan [Dalton Transactions, 2020, vol. 49, # 40, p. 14123 - 14132]

14
[ CAS Unavailable ]
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	at 160℃; for 48h; Autoclave;

15
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
45%	at 160℃; for 48h; Autoclave;

16
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
60%	at 160℃; for 48h; Autoclave;

17
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
58%	at 160℃; for 48h; Autoclave;

18
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ 144-62-7 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
62%	at 160℃; for 72h; Autoclave; High pressure;	4.2 General synthesis of[Ln(pta)(C2O4)0.5(H2O)2)]·1.5H2O(Ln = Tb, Sm) General procedure: A mixture of Ln(NO3)3·6H2O (0.10 mmol), H2pta (0.073 g,0.025 mmol), H2O (4 mL) and C2H5OH (2 mL) was heated at160 °C for three days in a 15 mL Teflon-lined stainless steelautoclave, which was then cooled to room temperature at arate of 3 K h-1. Colorless block crystals were collected byfiltration and dried in air.4.2.1 [Tb(pta)(C2O4)0.5(H2O)2)]·1.5H2O (1)Yield 62% (based on Tb3+). - Analysis (%) calcd. forC14H15NO10Tb: C 32.58, H 2.93, N 2.71; found C 32.54, H 3.01,N 2.69. - IR (KBr pellet, cm-1): 3350(m), 2897(w), 2348(s),1641(s), 1552(s), 1526(s), 1420(m), 1377(w), 1315(w),1069(m), 1007(w), 844(w), 770(m), 603(m).

Reference： [1]Ding, Runmei; He, Zixin; Wang, Meilin; Tian, Danian; Cen, Peipei [Zeitschrift fur Naturforschung, B: Chemical Sciences, 2021, vol. 76, # 1, p. 39 - 44]

19
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ 144-62-7 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
53%	at 160℃; for 72h; Autoclave; High pressure;	4.2 General synthesis of[Ln(pta)(C2O4)0.5(H2O)2)]·1.5H2O(Ln = Tb, Sm) General procedure: A mixture of Ln(NO3)3·6H2O (0.10 mmol), H2pta (0.073 g,0.025 mmol), H2O (4 mL) and C2H5OH (2 mL) was heated at160 °C for three days in a 15 mL Teflon-lined stainless steelautoclave, which was then cooled to room temperature at arate of 3 K h-1. Colorless block crystals were collected byfiltration and dried in air.

Reference： [1]Ding, Runmei; He, Zixin; Wang, Meilin; Tian, Danian; Cen, Peipei [Zeitschrift fur Naturforschung, B: Chemical Sciences, 2021, vol. 76, # 1, p. 39 - 44]

20
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 75-50-3 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	In ethanol; water at 169℃; for 96h; Autoclave;

Reference： [1]Duan, Lijuan; Guo, Yan; Liu, Xiangyu; Qin, Yuanyuan; Song, Weiming; Wang, Lu; Wu, Yuewei; Zhang, Chengcheng [Dalton Transactions, 2022, vol. 51, # 2, p. 473 - 477]

21
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 75-50-3 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
	In ethanol; water at 169℃; for 96h; Autoclave;

Reference： [1]Duan, Lijuan; Guo, Yan; Liu, Xiangyu; Qin, Yuanyuan; Song, Weiming; Wang, Lu; Wu, Yuewei; Zhang, Chengcheng [Dalton Transactions, 2022, vol. 51, # 2, p. 473 - 477]

22
[ CAS Unavailable ]
[ 1238617-40-7 ]
[ 7732-18-5 ]
[ CAS Unavailable ]

Yield	Reaction Conditions	Operation in experiment
62.3%	With trimethylamine In ethanol at 169℃; for 96h; Autoclave;

Reference： [1]Duan, Lijuan; Guo, Yan; Liu, Xiangyu; Qin, Yuanyuan; Song, Weiming; Wang, Lu; Wu, Yuewei; Zhang, Chengcheng [Dalton Transactions, 2022, vol. 51, # 2, p. 473 - 477]

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Code	Phrase
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P231	Handle under inert gas.
P232	Protect from moisture.
P233	Keep container tightly closed.
P234	Keep only in original container.
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P240	Ground/bond container and receiving equipment.
P241	Use explosion-proof electrical/ventilating/lighting/equipment.
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P251	Pressurized container: Do not pierce or burn, even after use.
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P261	Avoid breathing dust/fume/gas/mist/vapours/spray.
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P265	Wash skin thouroughly after handling.
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P272	Contaminated work clothing should not be allowed out of the workplace.
P273	Avoid release to the environment.
P280	Wear protective gloves/protective clothing/eye protection/face protection.
P281	Use personal protective equipment as required.
P282	Wear cold insulating gloves/face shield/eye protection.
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P284	Wear respiratory protection.
P285	In case of inadequate ventilation wear respiratory protection.
P231 + P232	Handle under inert gas. Protect from moisture.
P235 + P410	Keep cool. Protect from sunlight.
Response
Code	Phrase
P301	IF SWALLOWED:
P304	IF INHALED:
P305	IF IN EYES:
P306	IF ON CLOTHING:
P307	IF exposed:
P308	IF exposed or concerned:
P309	IF exposed or if you feel unwell:
P310	Immediately call a POISON CENTER or doctor/physician.
P311	Call a POISON CENTER or doctor/physician.
P312	Call a POISON CENTER or doctor/physician if you feel unwell.
P313	Get medical advice/attention.
P314	Get medical advice/attention if you feel unwell.
P315	Get immediate medical advice/attention.
P320
P302 + P352	IF ON SKIN: wash with plenty of soap and water.
P321
P322
P330	Rinse mouth.
P331	Do NOT induce vomiting.
P332	IF SKIN irritation occurs:
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P334	Immerse in cool water/wrap n wet bandages.
P335	Brush off loose particles from skin.
P336	Thaw frosted parts with lukewarm water. Do not rub affected area.
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P340	Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P341	If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P342	If experiencing respiratory symptoms:
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P351	Rinse cautiously with water for several minutes.
P352	Wash with plenty of soap and water.
P353	Rinse skin with water/shower.
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P361	Remove/Take off immediately all contaminated clothing.
P362	Take off contaminated clothing and wash before reuse.
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P376	Stop leak if safe to do so. Oxidising gases (section 2.4) 1
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P378
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P301 + P312	IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
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P302 + P334	IF ON SKIN: Immerse in cool water/wrap in wet bandages.
P302 + P350	IF ON SKIN: Gently wash with plenty of soap and water.
P303 + P361 + P353	IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P304 + P312	IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell.
P304 + P340	IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P304 + P341	IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338	IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P306 + P360	IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes.
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P332 + P313	IF SKIN irritation occurs: Get medical advice/attention.
P333 + P313	IF SKIN irritation or rash occurs: Get medical advice/attention.
P335 + P334	Brush off loose particles from skin. Immerse in cool water/wrap in wet bandages.
P337 + P313	IF eye irritation persists: Get medical advice/attention.
P342 + P311	IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.
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P370 + P378	In case of fire:
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H200	Unstable explosive
H201	Explosive; mass explosion hazard
H202	Explosive; severe projection hazard
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H231	May react explosively even in the absence of air at elevated pressure and/or temperature
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Health hazards
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H411	Toxic to aquatic life with long-lasting effects
H412	Harmful to aquatic life with long-lasting effects
H413	May cause long-lasting harmful effects to aquatic life
H420	Harms public health and the environment by destroying ozone in the upper atmosphere

[ CAS No. 1238617-40-7 ] {[proInfo.proName]}

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[ 1238617-40-7 ] Synthesis Path-Downstream 1~22

Precautionary Statements-General

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