Home Sulfos Benzoic acid, 3-(chlorosulfonyl)-2,6-difluoro-

Benzoic acid, 3-(chlorosulfonyl)-2,6-difluoro-

CAS No.:
142576-91-8
Catalog Number:
AG006Y8K
Molecular Formula:
C7H3ClF2O4S
Molecular Weight:
256.6111
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Product Description
Catalog Number:
AG006Y8K
Chemical Name:
Benzoic acid, 3-(chlorosulfonyl)-2,6-difluoro-
CAS Number:
142576-91-8
Molecular Formula:
C7H3ClF2O4S
Molecular Weight:
256.6111
MDL Number:
MFCD03030334
IUPAC Name:
3-chlorosulfonyl-2,6-difluorobenzoic acid
InChI:
InChI=1S/C7H3ClF2O4S/c8-15(13,14)4-2-1-3(9)5(6(4)10)7(11)12/h1-2H,(H,11,12)
InChI Key:
QOVXKOPZKHCCHN-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(F)ccc(c1F)S(=O)(=O)Cl
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.941g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.604g/mol
Monoisotopic Mass:
255.941g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties