Home Sulfos 5-Chloro-2,3-dihydro-2-oxobenzoxazole-6-sulfonic acid chloride

5-Chloro-2,3-dihydro-2-oxobenzoxazole-6-sulfonic acid chloride

CAS No.:
5791-05-9
Catalog Number:
AG00EQJB
Molecular Formula:
C7H3Cl2NO4S
Molecular Weight:
268.0740
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Product Description
Catalog Number:
AG00EQJB
Chemical Name:
5-Chloro-2,3-dihydro-2-oxobenzoxazole-6-sulfonic acid chloride
CAS Number:
5791-05-9
Molecular Formula:
C7H3Cl2NO4S
Molecular Weight:
268.0740
MDL Number:
MFCD12174751
IUPAC Name:
5-chloro-2-oxo-3H-1,3-benzoxazole-6-sulfonyl chloride
InChI:
InChI=1S/C7H3Cl2NO4S/c8-3-1-4-5(14-7(11)10-4)2-6(3)15(9,12)13/h1-2H,(H,10,11)
InChI Key:
BILROERYVIUOEP-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]c(=O)oc2cc1S(=O)(=O)Cl
EC Number:
227-326-8
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.916g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
268.064g/mol
Monoisotopic Mass:
266.916g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties