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27715-68-0

27715-68-0 | 3-Pyridinecarboxamide, 2-methyl-5-nitro-

CAS No: 27715-68-0 Catalog No: AG002UKO MDL No:

Product Description

Catalog Number:
AG002UKO
Chemical Name:
3-Pyridinecarboxamide, 2-methyl-5-nitro-
CAS Number:
27715-68-0
Molecular Formula:
C7H7N3O3
Molecular Weight:
181.1488
IUPAC Name:
2-methyl-5-nitropyridine-3-carboxamide
InChI:
InChI=1S/C7H7N3O3/c1-4-6(7(8)11)2-5(3-9-4)10(12)13/h2-3H,1H3,(H2,8,11)
InChI Key:
UKZVQIOQFZXJPF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(c(c1)C(=O)N)C

Properties

Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.049g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.151g/mol
Monoisotopic Mass:
181.049g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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