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1562-33-0 | Ethenesulfonic acid, 2-chlorophenyl ester
CAS No: 1562-33-0 Catalog No: AG001OLI MDL No:
Product Description
Catalog Number:
AG001OLI
Chemical Name:
Ethenesulfonic acid, 2-chlorophenyl ester
CAS Number:
1562-33-0
Molecular Formula:
C8H7ClO3S
Molecular Weight:
218.6574
IUPAC Name:
(2-chlorophenyl) ethenesulfonate
InChI:
InChI=1S/C8H7ClO3S/c1-2-13(10,11)12-8-6-4-3-5-7(8)9/h2-6H,1H2
InChI Key:
CIXIXUUXIXFCKH-UHFFFAOYSA-N
SMILES:
C=CS(=O)(=O)Oc1ccccc1Cl
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.98g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.651g/mol
Monoisotopic Mass:
217.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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