Home Sulfos 2,5-dichloro-3,6-dimethyl-benzenesulfonyl chloride

2,5-dichloro-3,6-dimethyl-benzenesulfonyl chloride

CAS No.:
854860-52-9
Catalog Number:
AG00IDOM
Molecular Formula:
C8H7Cl3O2S
Molecular Weight:
273.5640
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Product Description
Catalog Number:
AG00IDOM
Chemical Name:
2,5-dichloro-3,6-dimethyl-benzenesulfonyl chloride
CAS Number:
854860-52-9
Molecular Formula:
C8H7Cl3O2S
Molecular Weight:
273.5640
MDL Number:
MFCD06655261
IUPAC Name:
2,5-dichloro-3,6-dimethylbenzenesulfonyl chloride
InChI:
InChI=1S/C8H7Cl3O2S/c1-4-3-6(9)5(2)8(7(4)10)14(11,12)13/h3H,1-2H3
InChI Key:
QBTUHWBMGWMUGH-UHFFFAOYSA-N
SMILES:
Clc1cc(C)c(c(c1C)S(=O)(=O)Cl)Cl
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.923g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.552g/mol
Monoisotopic Mass:
271.923g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties