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263149-10-6 | 3-Quinolinecarbonitrile, 4-chloro-7-hydroxy-6-methoxy-
CAS No: 263149-10-6 Catalog No: AG002SOH MDL No:MFCD09833973
Product Description
Catalog Number:
AG002SOH
Chemical Name:
3-Quinolinecarbonitrile, 4-chloro-7-hydroxy-6-methoxy-
CAS Number:
263149-10-6
Molecular Formula:
C11H7ClN2O2
Molecular Weight:
234.6385
MDL Number:
MFCD09833973
IUPAC Name:
4-chloro-7-hydroxy-6-methoxyquinoline-3-carbonitrile
InChI:
InChI=1S/C11H7ClN2O2/c1-16-10-2-7-8(3-9(10)15)14-5-6(4-13)11(7)12/h2-3,5,15H,1H3
InChI Key:
QIORUBTUDLGIII-UHFFFAOYSA-N
SMILES:
COc1cc2c(cc1O)ncc(c2Cl)C#N
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.02g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.639g/mol
Monoisotopic Mass:
234.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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