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27802-70-6 | 2-Propene-1-sulfonic acid, 2-propen-1-yl ester
CAS No: 27802-70-6 Catalog No: AG002USO MDL No:
Product Description
Catalog Number:
AG002USO
Chemical Name:
2-Propene-1-sulfonic acid, 2-propen-1-yl ester
CAS Number:
27802-70-6
Molecular Formula:
C6H10O3S
Molecular Weight:
162.2068
IUPAC Name:
prop-2-enyl prop-2-ene-1-sulfonate
InChI:
InChI=1S/C6H10O3S/c1-3-5-9-10(7,8)6-4-2/h3-4H,1-2,5-6H2
InChI Key:
UCNQWKLSMBTNRS-UHFFFAOYSA-N
SMILES:
C=CCOS(=O)(=O)CC=C
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.035g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.203g/mol
Monoisotopic Mass:
162.035g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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