AG005WB4

6960-20-9 | 3-Methyl-5-nitropyridine

AG005WB4

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CAS Number	6960-20-9
Catalog Number	AG005WB4(AGN-PC-0JNPL6)
Chemical Name	3-Methyl-5-nitropyridine
IUPAC Name	3-methyl-5-nitropyridine
InChI	InChI=1S/C6H6N2O2/c1-5-2-6(8(9)10)4-7-3-5/h2-4H,1H3
InChI Key	OQWXZZCTJZOSGH-UHFFFAOYSA-N
MDL Number	MFCD04114214
Molecular Formula	C6H6N2O2
Molecular Weight	138.1240
NSC Number	69795
SMILES	CC1=CC(=CN=C1)[N+]([O-])=O
Synonyms	3-METHYL-5-NITROPYRIDINE, 6960-20-9, 5-Nitro-3-picoline, 3-Nitro-5-picoline, MFCD04114214, NSC69795, PubChem6645, AC1L5HJO, AC1Q5AVI, 5-methyl-3-nitropyridine, 3-Nitro-5-methylpyridine, ACMC-209o9m, 3-methyl-5-nitro-pyridine, Pyridine,3-methyl-5-nitro-, SCHEMBL488024, CTK5D0570, DTXSID00290585, OQWXZZCTJZOSGH-UHFFFAOYSA-N, ZX-AT010095, ANW-35720, KM1289, NSC-69795, OR3238, SBB065360, ZINC15886705, AKOS015842434, AB17987, AN-2253, FCH1121497, QC-6693, RP01157, VP14558, 3-Methyl-5-nitropyridine, >=96.0%, AC-24960, AJ-67975, CJ-15241, AB1007001, AX8022236, TC-020059, FT-0646488, Y9848, I02-0867, J-512875, C6H6N2O2, AR-1F4337, CID250373, Pyridine, 3-methyl-5-nitro- (9CI), 87798-74-1,

Complexity	132
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	138.043g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	138.126g/mol
Monoisotopic Mass	138.043g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	58.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317-H318-H311-H315-H319-H332
Packing Group
Precautionary statements	P280h-P309-P310-P280-P305+P351+P338
UN Code

Certificate of Analysis

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