AG003JFW

405-04-9 | 3-Fluoro-4-hydroxybenzonitrile

AG003JFW

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CAS Number	405-04-9
Catalog Number	AG003JFW(AGN-PC-0KL1ZY)
Chemical Name	3-Fluoro-4-hydroxybenzonitrile
IUPAC Name	3-fluoro-4-hydroxybenzonitrile
InChI	InChI=1S/C7H4FNO/c8-6-3-5(4-9)1-2-7(6)10/h1-3,10H
InChI Key	DPSSSDFTLVUJDH-UHFFFAOYSA-N
MDL Number	MFCD00215834
Molecular Formula	C7H4FNO
Molecular Weight	137.1112
SMILES	N#CC1=CC=C(O)C(F)=C1
Synonyms	3-Fluoro-4-hydroxybenzonitrile, 405-04-9, 4-cyano-2-fluorophenol, Benzonitrile, 3-fluoro-4-hydroxy-, 3-fluoro-4-hydroxy-benzonitrile, MFCD00215834, 3-fluoro-4-hydroxybenzenecarbonitrile, 3-fluoro-4-hydroxy benzonitrile, ACMC-209jep, 2-fluoro-4-cyanophenol, AC1MD3ED, 4-cyano-2-fluoro phenol, KSC493S8D, SCHEMBL200168, 3-fluoro-4-hydroxy-benzonitril, CTK3J3981, KS-00000EGP, DTXSID90382367, DPSSSDFTLVUJDH-UHFFFAOYSA-N, WT518, ACT12376, ZINC2558778, ANW-29423, CF-632, SBB059246, STL450321, AKOS005257724, AC-4071, AM61511, AN-6152, AS02587, CM13070, CS-W002523, DS-1510, MCULE-4927827488, PS-9100, RP01099, RTR-016176, TRA0085918, VZ26803, AJ-40190, AK-35068, BC226681, BR-35068, CJ-09447, SC-53448, SY014168, 3-Fluoro-4-hydroxybenzonitrile, AldrichCPR, 405-04-9 3-Fluoro-4-hydroxybenzonitrile, AB0006421, DB-028487, ST2410686, TR-016176, 4CH-006161, A6774, FT-0632100, ST51044336, V0455, B-3230, MFCD00215834 (97+%), I01-4829, 3-fluoro-4-cyanophenol, 4-Cyano-3-fluorophenol, 2-fluoro-4-benzonitrile, C7H4FNO, 2-Fluoro-4-hydroxybenzonitrile, 8-Methyl-N-Vanillyl-6-Nonenamide, ZINC02558778, ACN-050390, CID2782944, (E)-8-Methyl-N-vanillyl-6-nonenamide, BENZONITRILE, 2-FLUORO-4-HYDROXY-, (E)-N-[(4-HYDROXY-3-METHOXYPHENYL)METHYL]-8-METHYL-6-NONENAMIDE,

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	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
UN Code	UN 3439

Certificate of Analysis

Lot Number