AG00EBYJ

63365-23-1 | 2-Amino-6-nitrobenzonitrile

AG00EBYJ

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CAS Number	63365-23-1
Catalog Number	AG00EBYJ(AGN-PC-0NK05C)
Chemical Name	2-Amino-6-nitrobenzonitrile
IUPAC Name	2-amino-6-nitrobenzonitrile
InChI	InChI=1S/C7H5N3O2/c8-4-5-6(9)2-1-3-7(5)10(11)12/h1-3H,9H2
InChI Key	FEEQTCIVZQOKMJ-UHFFFAOYSA-N
MDL Number	MFCD08236739
Molecular Formula	C7H5N3O2
Molecular Weight	163.1335
SMILES	N#CC1=C([N+]([O-])=O)C=CC=C1N
Synonyms	2-amino-6-nitrobenzonitrile, 63365-23-1, 2-amino-6-nitro-benzonitrile, SCHEMBL2413571, Benzonitrile, 2-amino-6-nitro-, CTK5B8828, DTXSID80507805, FEEQTCIVZQOKMJ-UHFFFAOYSA-N, FCH858855, MFCD08236739, ZINC38540047, AKOS006284750, AB43894, AJ-96344, AK-26924, DS-10942, AX8070678, AM20040917,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	163.038g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	163.136g/mol
Monoisotopic Mass	163.038g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	95.6A^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-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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