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4663-99-4 | 3,5-Pyridinedicarboxamide
CAS No: 4663-99-4 Catalog No: AG00I8KZ MDL No:MFCD00229426
Product Description
Catalog Number:
AG00I8KZ
Chemical Name:
3,5-Pyridinedicarboxamide
CAS Number:
4663-99-4
Molecular Formula:
C7H7N3O2
Molecular Weight:
165.1494
MDL Number:
MFCD00229426
IUPAC Name:
pyridine-3,5-dicarboxamide
InChI:
InChI=1S/C7H7N3O2/c8-6(11)4-1-5(7(9)12)3-10-2-4/h1-3H,(H2,8,11)(H2,9,12)
InChI Key:
ANNOWMBWHHKGLN-UHFFFAOYSA-N
SMILES:
NC(=O)c1cncc(c1)C(=O)N
NSC Number:
523084
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.152g/mol
Monoisotopic Mass:
165.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
Literature
| Title | Journal |
|---|---|
| [A new flavonoid glucoside from Huanglianjiedutang decoction]. | Zhongguo Zhong yao za zhi = Zhongguo zhongyao zazhi = China journal of Chinese materia medica 20090501 |
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