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Home > Nitro Compounds > 856835-53-5
856835-53-5 | 4-Methyl-3-nitropyridine hydrochloride
CAS No: 856835-53-5 Catalog No: AG004Q5M MDL No:MFCD09909573
Product Description
Catalog Number:
AG004Q5M
Chemical Name:
4-Methyl-3-nitropyridine hydrochloride
CAS Number:
856835-53-5
Molecular Formula:
C6H7ClN2O2
Molecular Weight:
174.5850
MDL Number:
MFCD09909573
IUPAC Name:
4-methyl-3-nitropyridine;hydrochloride
InChI:
InChI=1S/C6H6N2O2.ClH/c1-5-2-3-7-4-6(5)8(9)10;/h2-4H,1H3;1H
InChI Key:
YJYIFDJCITXAAZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnccc1C.Cl
EC Number:
617-743-7
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.02g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.584g/mol
Monoisotopic Mass:
174.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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