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1017429-51-4

1017429-51-4 | 3-Quinolinemethanol, 2,5-dichloro-8-methyl-

CAS No: 1017429-51-4 Catalog No: AG0005DS MDL No:

Product Description

Catalog Number:
AG0005DS
Chemical Name:
3-Quinolinemethanol, 2,5-dichloro-8-methyl-
CAS Number:
1017429-51-4
Molecular Formula:
C11H9Cl2NO
Molecular Weight:
242.1013
IUPAC Name:
(2,5-dichloro-8-methylquinolin-3-yl)methanol
InChI:
InChI=1S/C11H9Cl2NO/c1-6-2-3-9(12)8-4-7(5-15)11(13)14-10(6)8/h2-4,15H,5H2,1H3
InChI Key:
STZYBZQTOCLIAP-UHFFFAOYSA-N
SMILES:
OCc1cc2c(Cl)ccc(c2nc1Cl)C

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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