Home Sulfos 5-chloro-1,3-benzothiazole-4-sulfonyl chloride

5-chloro-1,3-benzothiazole-4-sulfonyl chloride

CAS No.:
1094671-88-1
Catalog Number:
AG01ABMK
Molecular Formula:
C7H3Cl2NO2S2
Molecular Weight:
268.1402
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Product Description
Catalog Number:
AG01ABMK
Chemical Name:
5-chloro-1,3-benzothiazole-4-sulfonyl chloride
CAS Number:
1094671-88-1
Molecular Formula:
C7H3Cl2NO2S2
Molecular Weight:
268.1402
MDL Number:
MFCD11650767
IUPAC Name:
5-chloro-1,3-benzothiazole-4-sulfonyl chloride
InChI:
InChI=1S/C7H3Cl2NO2S2/c8-4-1-2-5-6(10-3-13-5)7(4)14(9,11)12/h1-3H
InChI Key:
JZAWJILQDJACID-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1S(=O)(=O)Cl)ncs2
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.898g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.126g/mol
Monoisotopic Mass:
266.898g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties