Home Halogens 7-chloro-2,3-dihydro-1lambda6,2-benzothiazole-1,1,3-trione

7-chloro-2,3-dihydro-1lambda6,2-benzothiazole-1,1,3-trione

CAS No.:
89999-91-7
Catalog Number:
AG01B85C
Molecular Formula:
C7H4ClNO3S
Molecular Weight:
217.6296
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Product Description
Catalog Number:
AG01B85C
Chemical Name:
7-chloro-2,3-dihydro-1lambda6,2-benzothiazole-1,1,3-trione
CAS Number:
89999-91-7
Molecular Formula:
C7H4ClNO3S
Molecular Weight:
217.6296
MDL Number:
MFCD27931829
IUPAC Name:
7-chloro-1,1-dioxo-1,2-benzothiazol-3-one
InChI:
InChI=1S/C7H4ClNO3S/c8-5-3-1-2-4-6(5)13(11,12)9-7(4)10/h1-3H,(H,9,10)
InChI Key:
MEFGCTZWJIQTTR-UHFFFAOYSA-N
SMILES:
O=C1NS(=O)(=O)c2c1cccc2Cl
Properties
Complexity:
334  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.96g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.623g/mol
Monoisotopic Mass:
216.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties