AG003KPR

6393-40-4 | 4-Amino-3-nitrobenzonitrile

AG003KPR

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CAS Number	6393-40-4
Catalog Number	AG003KPR(AGN-PC-0JTI1W)
Chemical Name	4-Amino-3-nitrobenzonitrile
IUPAC Name	4-amino-3-nitrobenzonitrile
InChI	InChI=1S/C7H5N3O2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2
InChI Key	JAHADAZIDZMHOP-UHFFFAOYSA-N
MDL Number	MFCD04038742
Molecular Formula	C7H5N3O2
Molecular Weight	163.1335
SMILES	N(=O)(=O)c1cc(C#N)ccc1N
Synonyms	4-Amino-3-nitrobenzonitrile, 6393-40-4, 3-Nitro-4-aminobenzonitrile, 4-Cyano-2-nitroaniline, Benzonitrile, 4-amino-3-nitro-, 4-amino-3-nitro-benzonitrile, MFCD00013373, 2-NITRO-4-CYANOANILINE, JAHADAZIDZMHOP-UHFFFAOYSA-N, 4-amino-3-nitrobenzenecarbonitrile, 4-Amino-3-nitrobenzonitrile, 98%, 6393-40-4 4-Amino-3-nitrobenzonitrile, zlchem 228, PubChem4669, 4-Ammo-3-nitrobenzonitrile, AC1LC7V7, 4-amino-3-nitroben-zonitrile, KSC356I5J, 3-Nitro-4-amino-benzonitrile, 4-Amino 3-nitro-benzonitrile, SCHEMBL203082, AC1Q51Y9, ACMC-1B671, BEN457, 1-amino-2-nitro-4-cyanobenzene, CTK2F6454, JAHADAZIDZMHOP-UHFFFAOYSA-, DTXSID00344315, ZLC0036, BUTTPARK 96\04-65, WT465, ACT00961, CS-M0344, EBD42974, ZINC4272115, AN-308, ANW-34776, CA-385, CL8204, SBB063015, WT2222, AKOS002347546, AS02596, AT-6925, CM12934, LS11733, MCULE-5768487416, PS-3054, RP02296, RTR-021962, TF10121, TRA0043469, KS-000009W6, AC-24724, AJ-50015, AK-35961, BC676390, BR-35961, CJ-11789, Q311, SC-06011, SY019312, AB0017511, DB-009535, TL8004518, TR-021962, 4CH-006635, AM20040938, FT-0082562, FT-0617503, ST24032733, ST50407370, EN300-19048, C-4869, MFCD00013373 (97+%), I01-0065, J-514370, 2,5-Dimethyl-p-phenylenediamine; 2,5-Diamino-p-xylene, Z1245633309, InChI=1/C7H5N3O2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2, C7H5N3O2, CID595901, ZINC04272115, ACN-050413, A1752, A2447, 4-Amino-3-nitrobenzonitrile, 98% - 1G 1g,

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	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number