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Home > Pyridines > 830317-01-6
830317-01-6 | 3-Pyridinol, 4-[(E)-(phenylimino)methyl]-
CAS No: 830317-01-6 Catalog No: AG004YBX MDL No:
Product Description
Catalog Number:
AG004YBX
Chemical Name:
3-Pyridinol, 4-[(E)-(phenylimino)methyl]-
CAS Number:
830317-01-6
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
IUPAC Name:
4-(phenyliminomethyl)pyridin-3-ol
InChI:
InChI=1S/C12H10N2O/c15-12-9-13-7-6-10(12)8-14-11-4-2-1-3-5-11/h1-9,15H
InChI Key:
MRFVISNWSHUPDQ-UHFFFAOYSA-N
SMILES:
Oc1cnccc1/C=N/c1ccccc1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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