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936345-80-1 | 5-hydroxyquinoline-8-carbonitrile
CAS No: 936345-80-1 Catalog No: AG00H14N MDL No:MFCD18415968
Product Description
Catalog Number:
AG00H14N
Chemical Name:
5-hydroxyquinoline-8-carbonitrile
CAS Number:
936345-80-1
Molecular Formula:
C10H6N2O
Molecular Weight:
170.1674
MDL Number:
MFCD18415968
IUPAC Name:
5-hydroxyquinoline-8-carbonitrile
InChI:
InChI=1S/C10H6N2O/c11-6-7-3-4-9(13)8-2-1-5-12-10(7)8/h1-5,13H
InChI Key:
WKAGWFVSIHNGOK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c2c1nccc2)O
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
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