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129083-19-8 | 3-Buten-2-ol, 4-(phenylsulfonyl)-, (3E)-
CAS No: 129083-19-8 Catalog No: AG000YU6 MDL No:
Product Description
Catalog Number:
AG000YU6
Chemical Name:
3-Buten-2-ol, 4-(phenylsulfonyl)-, (3E)-
CAS Number:
129083-19-8
Molecular Formula:
C10H12O3S
Molecular Weight:
212.2655
IUPAC Name:
4-(benzenesulfonyl)but-3-en-2-ol
InChI:
InChI=1S/C10H12O3S/c1-9(11)7-8-14(12,13)10-5-3-2-4-6-10/h2-9,11H,1H3
InChI Key:
JABFJGMKUVJZPC-UHFFFAOYSA-N
SMILES:
CC(/C=C/S(=O)(=O)c1ccccc1)O
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.263g/mol
Monoisotopic Mass:
212.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1
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