1215323-17-3|(4-(Methylsulfonyl)-2-(trifluoromethyl)phenyl)methanol| Ambeed

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CAS No. :	1215323-17-3
Formula :	C₉H₉F₃O₃S
M.W :	254.23
SMILES Code :	OCC1=CC=C(S(=O)(C)=O)C=C1C(F)(F)F
MDL No. :	MFCD26051393
InChI Key :	BAAPXLLEWXTKAZ-UHFFFAOYSA-N
Pubchem ID :	66936507

GHS Pictogram:
Signal Word:	Warning
Hazard Statements:	H319
Precautionary Statements:	P264-P280-P305+P351+P338-P337+P313

Yield	Reaction Conditions	Operation in experiment
	With sodium tetrahydroborate; In ethanol; at 0 - 20℃; for 16.5h;	b) (4-Methanesulfonyl-2-trifluoromethyl-phenyl)-methanol:; To a suspension of 4-methanesulfonyl-2-trifluoromethyl-benzaldehyde (49.2 g, 0.20 mol) in dry EtOH (500 ml), cooled in an ice-bath, is added sodium borohydride (10.8 g, 0.22 mol), portionwise over 30 mins. The reaction mixture is allowed to warm up slowly to room temperature then stirring is continued for 16 h. The reaction mixture is poured into a beaker of crushed ice (700 ml) and adjusted to pH 1 with 2N HCI (approx. 200 ml). The resulting pale yellow suspension is extracted with CH2CI2 (3 x 150 ml), dried (MgSO4) and evaporated to dryness in vacuo, to afford a pale yellow solid.
10 g	With methanol; sodium tetrahydroborate; at 0 - 20℃; for 2.0h;	Charged 10. Og of <strong>[1215310-75-0]4-(methylsulfonyl)-2-(trifluoromethyl)benzaldehyde</strong> in methanol and added 1.5 eq of sodium borohydride at 0C. Heated the reaction to room temperature and stirred for 2hrs. After completion of reaction, quenched the reaction with water and extracted the compound in ethyl acetate (3x). Combined the organic layers and concentrated under vacuum to give 10. Og of (4-(methyl sulfonyl)-2-(trifluoromethyl)phenyl)methanol.

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P337 + P313	IF eye irritation persists: Get medical advice/attention.
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P370 + P378	In case of fire:
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Disposal
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CAS No.: 1215323-17-3

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CAS No.: 1215323-17-3

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[ 1215323-17-3 ] Synthesis Path-Downstream 1~2

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Physical hazards
Code	Phrase
H200	Unstable explosive
H201	Explosive; mass explosion hazard
H202	Explosive; severe projection hazard
H203	Explosive; fire, blast or projection hazard
H204	Fire or projection hazard
H205	May mass explode in fire
H220	Extremely flammable gas
H221	Flammable gas
H222	Extremely flammable aerosol
H223	Flammable aerosol
H224	Extremely flammable liquid and vapour
H225	Highly flammable liquid and vapour
H226	Flammable liquid and vapour
H227	Combustible liquid
H228	Flammable solid
H229	Pressurized container: may burst if heated
H230	May react explosively even in the absence of air
H231	May react explosively even in the absence of air at elevated pressure and/or temperature
H240	Heating may cause an explosion
H241	Heating may cause a fire or explosion
H242	Heating may cause a fire
H250	Catches fire spontaneously if exposed to air
H251	Self-heating; may catch fire
H252	Self-heating in large quantities; may catch fire
H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
H270	May cause or intensify fire; oxidizer
H271	May cause fire or explosion; strong oxidizer
H272	May intensify fire; oxidizer
H280	Contains gas under pressure; may explode if heated
H281	Contains refrigerated gas; may cause cryogenic burns or injury
H290	May be corrosive to metals
Health hazards
Code	Phrase
H300	Fatal if swallowed
H301	Toxic if swallowed
H302	Harmful if swallowed
H303	May be harmful if swallowed