AG001XMH

1678-53-1 | 4-Nitro-3-methylpyridine

AG001XMH

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CAS Number	1678-53-1
Catalog Number	AG001XMH(AGN-PC-0JWIIF)
Chemical Name	4-Nitro-3-methylpyridine
IUPAC Name	3-methyl-4-nitropyridine
InChI	InChI=1S/C6H6N2O2/c1-5-4-7-3-2-6(5)8(9)10/h2-4H,1H3
InChI Key	UYAWSMUOLFSNGC-UHFFFAOYSA-N
MDL Number	MFCD03095084
Molecular Formula	C6H6N2O2
Molecular Weight	138.1240
SMILES	O=[N+](C1=C(C)C=NC=C1)[O-]
Synonyms	3-methyl-4-nitropyridine, 1678-53-1, 4-Nitro-3-picoline, 4-NITRO-3-METHYLPYRIDINE, 3-Picoline, 4-nitro-, 3-methyl-4-nitro-pyridine, AK-26806, PubChem6642, AC1LGAW5, ACMC-1C2X3, SCHEMBL171809, Pyridine, 3-methyl-4-nitro-, CTK3J4439, DTXSID60168372, ZINC332952, KS-000003ME, ANW-22313, FCH926026, MFCD03095084, WT1515, AKOS002663477, PB15731, QC-6690, RP20417, RTR-007276, VP10388, 1678-53-1 3-methyl-4-nitropyridine, AC-25148, AJ-19570, AN-49675, AS-38162, CJ-02861, SC-73752, ZB010683, AB0051002, AB1005367, AX8032212, DB-000197, ST2417795, TR-007276, 4CH-013318, AM20050866, CS-0051256, FT-0082381, FT-0650459, B-3795, 678M531, A810913, I02-0843, J-512857, F1371-0142, null, C6-H6-N2-O2, CID818233, ZINC00332952, ACN-052239,

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-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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