AG005UZV

757247-99-7 | 4-Amino-2-chloro-3-fluorobenzonitrile

AG005UZV

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CAS Number	757247-99-7
Catalog Number	AG005UZV(AGN-PC-09RX9I)
Chemical Name	4-Amino-2-chloro-3-fluorobenzonitrile
IUPAC Name	4-amino-2-chloro-3-fluorobenzonitrile
InChI	InChI=1S/C7H4ClFN2/c8-6-4(3-10)1-2-5(11)7(6)9/h1-2H,11H2
InChI Key	XSTLYVVLZCCQOC-UHFFFAOYSA-N
MDL Number	MFCD06808834
Molecular Formula	C7H4ClFN2
Molecular Weight	170.5715
SMILES	N#CC1=CC=C(N)C(F)=C1Cl
Synonyms	4-AMINO-2-CHLORO-3-FLUOROBENZONITRILE, 757247-99-7, 4-AMINO-3-FLUORO-2-CHLOROBENZONITRILE, Benzonitrile, 4-amino-2-chloro-3-fluoro-, SCHEMBL363348, CTK5E1919, KS-00000NXH, DTXSID70697143, XSTLYVVLZCCQOC-UHFFFAOYSA-N, ACT00957, BUTTPARK 100\07-74, ANW-46257, BBL102808, CL8201, MFCD06808834, STL556616, ZINC37597629, AKOS005255624, 2-Chloro-3-fluoro-4-aminobenzonitrile, AS05776, CM12910, AJ-94146, AK-86426, Benzonitrile,4-amino-2-chloro-3-fluoro-, DS-18177, AB0026593, ST2405520, TC-135002, W8294, X-4027, F0001-1914, C7H4ClFN2, 2,6-Ditert-butyl-4-vinylphenol, 19263-36-6,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170.005g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.571g/mol
Monoisotopic Mass	170.005g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number