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696612-04-1 | 3-Chloroquinolin-6-ol
CAS No: 696612-04-1 Catalog No: AG0039XS MDL No:MFCD18413746
Product Description
Catalog Number:
AG0039XS
Chemical Name:
3-Chloroquinolin-6-ol
CAS Number:
696612-04-1
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
MDL Number:
MFCD18413746
IUPAC Name:
3-chloroquinolin-6-ol
InChI:
InChI=1S/C9H6ClNO/c10-7-3-6-4-8(12)1-2-9(6)11-5-7/h1-5,12H
InChI Key:
JZUCTMVWDCGGGG-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)cc(cn2)Cl
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.014g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.603g/mol
Monoisotopic Mass:
179.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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