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157398-26-0 | 3-Pyridinecarboxylic acid, 6-(2-propylidenehydrazinyl)-
CAS No: 157398-26-0 Catalog No: AG001PEQ MDL No:
Product Description
Catalog Number:
AG001PEQ
Chemical Name:
3-Pyridinecarboxylic acid, 6-(2-propylidenehydrazinyl)-
CAS Number:
157398-26-0
Molecular Formula:
C9H11N3O2
Molecular Weight:
193.2025
IUPAC Name:
6-(2-propylidenehydrazinyl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C9H11N3O2/c1-2-5-11-12-8-4-3-7(6-10-8)9(13)14/h3-6H,2H2,1H3,(H,10,12)(H,13,14)
InChI Key:
JGXXKELQSIBFBK-UHFFFAOYSA-N
SMILES:
CCC=NNc1ccc(cn1)C(=O)O
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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