Home Sulfos 2-chloro-3-cyanobenzene-1-sulfonyl chloride

2-chloro-3-cyanobenzene-1-sulfonyl chloride

CAS No.:
1261851-22-2
Catalog Number:
AG01BU95
Molecular Formula:
C7H3Cl2NO2S
Molecular Weight:
236.0752
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Product Description
Catalog Number:
AG01BU95
Chemical Name:
2-chloro-3-cyanobenzene-1-sulfonyl chloride
CAS Number:
1261851-22-2
Molecular Formula:
C7H3Cl2NO2S
Molecular Weight:
236.0752
MDL Number:
MFCD18392426
IUPAC Name:
2-chloro-3-cyanobenzenesulfonyl chloride
InChI:
InChI=1S/C7H3Cl2NO2S/c8-7-5(4-10)2-1-3-6(7)13(9,11)12/h1-3H
InChI Key:
WQXMZVBJPSDLST-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1Cl)S(=O)(=O)Cl
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.926g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.066g/mol
Monoisotopic Mass:
234.926g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties