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100517-53-1 | 3-hydroxyquinoline-4-carbonitrile
CAS No: 100517-53-1 Catalog No: AG0096IR MDL No:
Product Description
Catalog Number:
AG0096IR
Chemical Name:
3-hydroxyquinoline-4-carbonitrile
CAS Number:
100517-53-1
IUPAC Name:
3-hydroxyquinoline-4-carbonitrile
InChI:
InChI=1S/C10H6N2O/c11-5-8-7-3-1-2-4-9(7)12-6-10(8)13/h1-4,6,13H
InChI Key:
HCVZROBIXCHBQQ-UHFFFAOYSA-N
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:
2.1
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