Home Sulfos 1,3-Benzothiazole-5-sulfonyl chloride

1,3-Benzothiazole-5-sulfonyl chloride

CAS No.:
227278-83-3
Catalog Number:
AG00BLH4
Molecular Formula:
C7H4ClNO2S2
Molecular Weight:
233.6952
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Product Description
Catalog Number:
AG00BLH4
Chemical Name:
1,3-Benzothiazole-5-sulfonyl chloride
CAS Number:
227278-83-3
Molecular Formula:
C7H4ClNO2S2
Molecular Weight:
233.6952
MDL Number:
MFCD20233448
IUPAC Name:
1,3-benzothiazole-5-sulfonyl chloride
InChI:
InChI=1S/C7H4ClNO2S2/c8-13(10,11)5-1-2-7-6(3-5)9-4-12-7/h1-4H
InChI Key:
LDHVFSWXNMEGPU-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ccc2c(c1)ncs2
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.937g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.684g/mol
Monoisotopic Mass:
232.937g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties