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1017403-83-6 | 3-Quinolinemethanol, 2,7-dichloro-8-methyl-
CAS No: 1017403-83-6 Catalog No: AG0005D2 MDL No:
Product Description
Catalog Number:
AG0005D2
Chemical Name:
3-Quinolinemethanol, 2,7-dichloro-8-methyl-
CAS Number:
1017403-83-6
Molecular Formula:
C11H9Cl2NO
Molecular Weight:
242.1013
IUPAC Name:
(2,7-dichloro-8-methylquinolin-3-yl)methanol
InChI:
InChI=1S/C11H9Cl2NO/c1-6-9(12)3-2-7-4-8(5-15)11(13)14-10(6)7/h2-4,15H,5H2,1H3
InChI Key:
PVIVNROWACGOBL-UHFFFAOYSA-N
SMILES:
OCc1cc2ccc(c(c2nc1Cl)C)Cl
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.006g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.099g/mol
Monoisotopic Mass:
241.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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