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1823-47-8 | Phenol, 2-[(2-pyridinylimino)methyl]-
CAS No: 1823-47-8 Catalog No: AG0023LH MDL No:
Product Description
Catalog Number:
AG0023LH
Chemical Name:
Phenol, 2-[(2-pyridinylimino)methyl]-
CAS Number:
1823-47-8
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
IUPAC Name:
2-[(E)-pyridin-2-yliminomethyl]phenol
InChI:
InChI=1S/C12H10N2O/c15-11-6-2-1-5-10(11)9-14-12-7-3-4-8-13-12/h1-9,15H/b14-9+
InChI Key:
DYOIUODXXXAPDU-NTEUORMPSA-N
SMILES:
Oc1ccccc1C=Nc1ccccn1
NSC Number:
96380
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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:
2.1
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