AG00I2W4

193090-61-8 | Benzonitrile, 4-amino-2,3-dichloro-

AG00I2W4

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CAS Number	193090-61-8
Catalog Number	AG00I2W4(AGN-PC-0NFZE8)
Chemical Name	Benzonitrile, 4-amino-2,3-dichloro-
IUPAC Name	4-amino-2,3-dichlorobenzonitrile
InChI	InChI=1S/C7H4Cl2N2/c8-6-4(3-10)1-2-5(11)7(6)9/h1-2H,11H2
InChI Key	XDJNPFJHLFODNI-UHFFFAOYSA-N
MDL Number	MFCD20720875
Molecular Formula	C7H4Cl2N2
Molecular Weight	187.0261
SMILES	NC1=CC=C(C#N)C(Cl)=C1Cl
Synonyms	4-Amino-2,3-dichlorobenzonitrile, 193090-61-8, SCHEMBL20567319, MFCD20720875, ZINC38251529, Benzonitrile, 4-amino-2,3-dichloro-, CS-0059844, 4-amino-2,3-dichloro-benzonitrile, CID11106078,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.975g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.023g/mol
Monoisotopic Mass	185.975g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	49.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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