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1017788-66-7 | 3-Quinolinecarbonitrile, 4-chloro-7-hydroxy-
CAS No: 1017788-66-7 Catalog No: AG0005J8 MDL No:
Product Description
Catalog Number:
AG0005J8
Chemical Name:
3-Quinolinecarbonitrile, 4-chloro-7-hydroxy-
CAS Number:
1017788-66-7
Molecular Formula:
C10H5ClN2O
Molecular Weight:
204.6125
IUPAC Name:
4-chloro-7-hydroxyquinoline-3-carbonitrile
InChI:
InChI=1S/C10H5ClN2O/c11-10-6(4-12)5-13-9-3-7(14)1-2-8(9)10/h1-3,5,14H
InChI Key:
ATENTCYDIFPJRQ-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1Cl)ccc(c2)O
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.009g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.613g/mol
Monoisotopic Mass:
204.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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