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15462-43-8 | 2-Quinolinecarbonitrile,3-hydroxy-
CAS No: 15462-43-8 Catalog No: AG007XGA MDL No:
Product Description
Catalog Number:
AG007XGA
Chemical Name:
2-Quinolinecarbonitrile,3-hydroxy-
CAS Number:
15462-43-8
Molecular Formula:
C10H6N2O
Molecular Weight:
170.1674
IUPAC Name:
3-hydroxyquinoline-2-carbonitrile
InChI:
InChI=1S/C10H6N2O/c11-6-9-10(13)5-7-3-1-2-4-8(7)12-9/h1-5,13H
InChI Key:
HQMDFABEUPPGNK-UHFFFAOYSA-N
SMILES:
N#Cc1nc2ccccc2cc1O
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.171g/mol
Monoisotopic Mass:
170.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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