Home Halogens 5-chloro-1,3-dihydro-2lambda6,1-benzothiazole-2,2-dione

5-chloro-1,3-dihydro-2lambda6,1-benzothiazole-2,2-dione

CAS No.:
111310-59-9
Catalog Number:
AG01C3II
Molecular Formula:
C7H6ClNO2S
Molecular Weight:
203.6460
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Product Description
Catalog Number:
AG01C3II
Chemical Name:
5-chloro-1,3-dihydro-2lambda6,1-benzothiazole-2,2-dione
CAS Number:
111310-59-9
Molecular Formula:
C7H6ClNO2S
Molecular Weight:
203.6460
MDL Number:
MFCD19105164
IUPAC Name:
5-chloro-1,3-dihydro-2,1-benzothiazole 2,2-dioxide
InChI:
InChI=1S/C7H6ClNO2S/c8-6-1-2-7-5(3-6)4-12(10,11)9-7/h1-3,9H,4H2
InChI Key:
ZOQPCTNXWYKEAN-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)CS(=O)(=O)N2
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.981g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.64g/mol
Monoisotopic Mass:
202.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties