Home Halogens 3-chloro-4-Methylthiobenzylchloride

3-chloro-4-Methylthiobenzylchloride

CAS No.:
109418-89-5
Catalog Number:
AG00929K
Molecular Formula:
C8H8Cl2S
Molecular Weight:
207.1201
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Product Description
Catalog Number:
AG00929K
Chemical Name:
3-chloro-4-Methylthiobenzylchloride
CAS Number:
109418-89-5
Molecular Formula:
C8H8Cl2S
Molecular Weight:
207.1201
MDL Number:
MFCD22489924
IUPAC Name:
2-chloro-4-(chloromethyl)-1-methylsulfanylbenzene
InChI:
InChI=1S/C8H8Cl2S/c1-11-8-3-2-6(5-9)4-7(8)10/h2-4H,5H2,1H3
InChI Key:
CDAAPXAACBSAHC-UHFFFAOYSA-N
SMILES:
ClCc1ccc(c(c1)Cl)SC
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.972g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.112g/mol
Monoisotopic Mass:
205.972g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties