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71263-74-6 | 2-Propenoic acid, 2-sulfopropyl ester
CAS No: 71263-74-6 Catalog No: AG005K10 MDL No:
Product Description
Catalog Number:
AG005K10
Chemical Name:
2-Propenoic acid, 2-sulfopropyl ester
CAS Number:
71263-74-6
Molecular Formula:
C6H10O5S
Molecular Weight:
194.2056
IUPAC Name:
1-prop-2-enoyloxypropane-2-sulfonic acid
InChI:
InChI=1S/C6H10O5S/c1-3-6(7)11-4-5(2)12(8,9)10/h3,5H,1,4H2,2H3,(H,8,9,10)
InChI Key:
NKIIKKAXXDXYJS-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCC(S(=O)(=O)O)C
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.201g/mol
Monoisotopic Mass:
194.025g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
89A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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