AG00DAC7

473923-95-4 | Benzonitrile, 3-​fluoro-​5-​hydroxy-

AG00DAC7

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CAS Number	473923-95-4
Catalog Number	AG00DAC7(AGN-PC-03I6FD)
Chemical Name	Benzonitrile, 3-​fluoro-​5-​hydroxy-
IUPAC Name	3-fluoro-5-hydroxybenzonitrile
InChI	InChI=1S/C7H4FNO/c8-6-1-5(4-9)2-7(10)3-6/h1-3,10H
InChI Key	ATVNHLQIIAOSEM-UHFFFAOYSA-N
MDL Number	MFCD09972133
Molecular Formula	C7H4FNO
Molecular Weight	137.1112
SMILES	C(#N)c1cc(F)cc(c1)O
Synonyms	3-FLUORO-5-HYDROXYBENZONITRILE, 473923-95-4, 3-cyano-5-fluorophenol, SCHEMBL508381, ACMC-209k94, CTK4I9939, DTXSID80620629, ATVNHLQIIAOSEM-UHFFFAOYSA-N, ACT11852, KS-000010IO, ANW-30518, CL8194, MFCD09972133, ZINC38536986, AKOS006310703, CS-W001086, DS-2542, AJ-95784, AK-64303, CJ-19313, SY024495, 3-Fluoro-5-hydroxybenzonitrile, AldrichCPR, TR-017496, 4CH-010337, ST24028527, X7966, MFCD09972133 (95%), B-3505, I01-11710, C7H4FNO,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	137.028g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	137.113g/mol
Monoisotopic Mass	137.028g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	44A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3082

Certificate of Analysis

Lot Number