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83282-01-3 | 2-Pyridinecarboxylic acid, 6-(2-phenylethenyl)-
CAS No: 83282-01-3 Catalog No: AG0055VK MDL No:
Product Description
Catalog Number:
AG0055VK
Chemical Name:
2-Pyridinecarboxylic acid, 6-(2-phenylethenyl)-
CAS Number:
83282-01-3
Molecular Formula:
C14H11NO2
Molecular Weight:
225.2426
IUPAC Name:
6-(2-phenylethenyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C14H11NO2/c16-14(17)13-8-4-7-12(15-13)10-9-11-5-2-1-3-6-11/h1-10H,(H,16,17)
InChI Key:
MFSODSPULJWESH-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(n1)C=Cc1ccccc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.247g/mol
Monoisotopic Mass:
225.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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