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6759-78-0 | 8-Hydroxyquinoline-2-carbonitrile
CAS No: 6759-78-0 Catalog No: AG003NIH MDL No:MFCD00216717
Product Description
Catalog Number:
AG003NIH
Chemical Name:
8-Hydroxyquinoline-2-carbonitrile
CAS Number:
6759-78-0
Molecular Formula:
C10H6N2O
Molecular Weight:
170.1674
MDL Number:
MFCD00216717
IUPAC Name:
8-hydroxyquinoline-2-carbonitrile
InChI:
InChI=1S/C10H6N2O/c11-6-8-5-4-7-2-1-3-9(13)10(7)12-8/h1-5,13H
InChI Key:
KUQKKIBQVSFDHX-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(n1)c(O)ccc2
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:
1.9
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