AG004KOG

873697-68-8 | 3-amino-2-fluorobenzonitrile

AG004KOG

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CAS Number	873697-68-8
Catalog Number	AG004KOG(AGN-PC-05ZTK8)
Chemical Name	3-amino-2-fluorobenzonitrile
IUPAC Name	3-amino-2-fluorobenzonitrile
InChI	InChI=1S/C7H5FN2/c8-7-5(4-9)2-1-3-6(7)10/h1-3H,10H2
InChI Key	BFGCKEHSFRPNRZ-UHFFFAOYSA-N
MDL Number	MFCD08062434
Molecular Formula	C7H5FN2
Molecular Weight	136.1264
SMILES	C(#N)c1c(F)c(N)ccc1
Synonyms	3-amino-2-fluorobenzonitrile, 873697-68-8, 3-Cyano-2-fluoroaniline, cyano(3-)-2-fluoroaniline, Benzonitrile, 3-amino-2-fluoro-, SCHEMBL663487, 3-Amino-2-fluoro-benzonitrile, CTK5F8300, DTXSID70654630, BFGCKEHSFRPNRZ-UHFFFAOYSA-N, ZINC8700947, 3821AC, ANW-56073, MFCD08062434, AKOS006285224, AB43380, AS05781, CM12920, RP20248, RTR-038109, AJ-58519, AK-37393, AS-42284, TR-038109, FT-0678222, C-6133, J-511539, I01-15859, C7H5FN2,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.044g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	136.129g/mol
Monoisotopic Mass	136.044g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301+H311+H331
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P310-P311
UN Code	UN 3439

Certificate of Analysis

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