AG00GUWS

936841-71-3 | 3-Hydroxy-4-(trifluoromethyl)pyridine

AG00GUWS

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CAS Number	936841-71-3
Catalog Number	AG00GUWS(AGN-PC-0W3AOG)
Chemical Name	3-Hydroxy-4-(trifluoromethyl)pyridine
IUPAC Name	4-(trifluoromethyl)pyridin-3-ol
InChI	InChI=1S/C6H4F3NO/c7-6(8,9)4-1-2-10-3-5(4)11/h1-3,11H
InChI Key	WKCPGVBFXQBORW-UHFFFAOYSA-N
MDL Number	MFCD11035957
Molecular Formula	C6H4F3NO
Molecular Weight	163.0973
SMILES	OC1=C(C(F)(F)F)C=CN=C1
Synonyms	936841-71-3, 4-(Trifluoromethyl)pyridin-3-ol, 3-Hydroxy-4-(trifluoromethyl)pyridine, 4-Trifluoromethylpyridin-3-ol, 4-Trifluoromethyl-pyridin-3-ol, 3-Hydroxy-4-trifluoromethyl pyridine, 3-Hydroxy -4-trifluoromethylpyridine, 4-(Trifluoromethyl)-3-pyridinol, MFCD11035957, Propane,1,3,3-trichloro-1,1-difluoro-, SCHEMBL1973448, CTK4I9134, DTXSID80649097, WKCPGVBFXQBORW-UHFFFAOYSA-N, CH-635, ZINC19616318, AKOS005145643, CM14444, MB09036, QC-4009, AJ-74061, AN-26216, SC-49003, BB 0261900, CS-0060138, FT-0654617, V1349, 4-(TRIFLUOROMETHYL)-3-HYDROXYPYRIDINE, Z-1848, 3-Hydroxy-alpha,alpha,alpha-trifluoro-4-picoline, 841T713, 3S109969, I02-1791, J-512633, 4-(trifluoromethyl)pyridin-3-ol, 3-hydroxy-alpha,alpha,alpha-trifluoro-4-picoline, C6H4F3NO, 460-63-9,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.024g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	163.099g/mol
Monoisotopic Mass	163.024g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	33.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number