AG003JTH

619-26-1 | N-Methyl-3-nitroaniline

AG003JTH

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CAS Number	619-26-1
Catalog Number	AG003JTH(AGN-PC-0BTALK)
Chemical Name	N-Methyl-3-nitroaniline
IUPAC Name	N-methyl-3-nitroaniline
InChI	InChI=1S/C7H8N2O2/c1-8-6-3-2-4-7(5-6)9(10)11/h2-5,8H,1H3
InChI Key	IKSRCCUOUJJGAU-UHFFFAOYSA-N
MDL Number	MFCD00963641
Molecular Formula	C7H8N2O2
Molecular Weight	152.1506
NSC Number	1137
SMILES	CNC1=CC(=CC=C1)[N+]([O-])=O
Synonyms	n-methyl-3-nitroaniline, 619-26-1, 3-Nitro-N-methylaniline, N-METHYL-M-NITROANILINE, Benzenamine, N-methyl-3-nitro-, IKSRCCUOUJJGAU-UHFFFAOYSA-N, MFCD00963641, N-Methyl-3-nitro-aniline, NSC1137, ACMC-1B45L, SCHEMBL732435, 3-Nitro-N-methylaniline 97%, 3-Nitro-N-methylaniline, 97%, SCHEMBL10163197, CTK2F7266, DTXSID50277205, AC1L5756, AC1Q2008, NSC-1137, ZINC1587879, ANW-67312, N-Methyl-N-(3-nitrophenyl)amine #, AKOS003626104, MCULE-9192275732, NE61718, AJ-27645, TC-156057, M3042, AE-562/40529760, A1-00927, Z1295543856, AR-1K7563, CID219622, 56239-27-1,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.059g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	152.153g/mol
Monoisotopic Mass	152.059g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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