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1017429-35-4,MFCD09997988
Catalog No.:AA0005B3
1017429-35-4 | 2,6-Dichloroquinoline-3-methanol
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Technical Information
Catalog Number:
AA0005B3
Chemical Name:
2,6-Dichloroquinoline-3-methanol
CAS Number:
1017429-35-4
Molecular Formula:
C10H7Cl2NO
Molecular Weight:
228.0747
MDL Number:
MFCD09997988
IUPAC Name:
(2,6-dichloroquinolin-3-yl)methanol
InChI:
InChI=1S/C10H7Cl2NO/c11-8-1-2-9-6(4-8)3-7(5-14)10(12)13-9/h1-4,14H,5H2
InChI Key:
RGVUMJRZROPQIV-UHFFFAOYSA-N
SMILES:
OCc1cc2cc(Cl)ccc2nc1Cl
Properties
Computed Properties
 
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.99g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.072g/mol
Monoisotopic Mass:
226.99g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
2,6-Dichloroquinoline-3-methanol 
1017429-35-4 
RT-016460 
FT-0758641 
T6109 
2,6-Dichloroquinoline-3-methanol, AldrichCPR 
(2,6-dichloroquinolin-3-yl)methanol 
CID10680826 
CTK8E3560 
DTXSID30443441 
3-Quinolinemethanol, 2,6-dichloro- 
MFCD09997988 
ZINC11727617 
FCH1397450 
OR309256 
DB-057874 
Literature
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