Home Halogens 2-chloro-3-(chloromethyl)-7-(methylsulfanyl)quinoline

2-chloro-3-(chloromethyl)-7-(methylsulfanyl)quinoline

CAS No.:
794582-34-6
Catalog Number:
AG00ID1L
Molecular Formula:
C11H9Cl2NS
Molecular Weight:
258.1669
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Product Description
Catalog Number:
AG00ID1L
Chemical Name:
2-chloro-3-(chloromethyl)-7-(methylsulfanyl)quinoline
CAS Number:
794582-34-6
Molecular Formula:
C11H9Cl2NS
Molecular Weight:
258.1669
MDL Number:
MFCD06368065
IUPAC Name:
2-chloro-3-(chloromethyl)-7-methylsulfanylquinoline
InChI:
InChI=1S/C11H9Cl2NS/c1-15-9-3-2-7-4-8(6-12)11(13)14-10(7)5-9/h2-5H,6H2,1H3
InChI Key:
DFPDJKQUDGUIQV-UHFFFAOYSA-N
SMILES:
CSc1ccc2c(c1)nc(c(c2)CCl)Cl
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.983g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.16g/mol
Monoisotopic Mass:
256.983g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties