AG003FK5

59146-96-2 | 2,3-Dimethyl-6-nitroaniline

AG003FK5

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CAS Number	59146-96-2
Catalog Number	AG003FK5(AGN-PC-0JTIUR)
Chemical Name	2,3-Dimethyl-6-nitroaniline
IUPAC Name	2,3-dimethyl-6-nitroaniline
InChI	InChI=1S/C8H10N2O2/c1-5-3-4-7(10(11)12)8(9)6(5)2/h3-4H,9H2,1-2H3
InChI Key	YEFYPFWBLCARLC-UHFFFAOYSA-N
MDL Number	MFCD00010148
Molecular Formula	C8H10N2O2
Molecular Weight	166.1772
SMILES	NC1=C([N+]([O-])=O)C=CC(C)=C1C
Synonyms	2,3-Dimethyl-6-nitroaniline, 59146-96-2, 6-Nitro-2,3-xylidine, 2,3-dimethyl-6-nitro-aniline, YEFYPFWBLCARLC-UHFFFAOYSA-N, 2,3-dimethyl-6-nitrophenylamine, 4-Nitro-3-aminoxylol, ACMC-209mau, AC1LC9UD, AC1Q2JG0, SCHEMBL2656793, CTK5A9504, 2,3-Dimethyl-6-nitrobenzenamine, DTXSID60344472, ZINC4100736, Benzenamine,2,3-dimethyl-6-nitro-, ANW-33172, MFCD00010148, SBB006536, benzenamine, 2,3-dimethyl-6-nitro-, AKOS000121611, MCULE-6052987028, KS-0000165K, AJ-48053, DB-053328, TC-121917, FT-0609704, N0500, ST24038565, ST50405102, X6989, A832183, AQ-012/42718517, I14-51320, InChI=1/C8H10N2O2/c1-5-3-4-7(10(11)12)8(9)6(5)2/h3-4H,9H2,1-2H, C8H10N2O2, CID597166, ZINC04100736, ACN-054215,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.074g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	166.18g/mol
Monoisotopic Mass	166.074g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	71.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

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