1-ethenylsulfonylpropan-2-ol

C5H10O3S — CID 19808252

IUPAC1-ethenylsulfonylpropan-2-ol
SMILESC=CS(=O)(=O)CC(C)O
InChIInChI=1S/C5H10O3S/c1-3-9(7,8)4-5(2)6/h3,5-6H,1,4H2,2H3
InChIKeyLBKZKSWKRXFZLR-UHFFFAOYSA-N
MW150.20 g/mol
LogP-0.07
Rot. Bonds3

About 1-ethenylsulfonylpropan-2-ol

1-ethenylsulfonylpropan-2-ol (PubChem CID 19808252) has the molecular formula C5H10O3S and a molecular weight of 150.20 g/mol. Its IUPAC name is 1-ethenylsulfonylpropan-2-ol.

Molecular Properties

Compound Name1-ethenylsulfonylpropan-2-ol
PubChem CID19808252
Molecular FormulaC5H10O3S
Molecular Weight150.20 g/mol
Exact Mass150.04
IUPAC Name1-ethenylsulfonylpropan-2-ol
SMILESC=CS(=O)(=O)CC(C)O
InChIInChI=1S/C5H10O3S/c1-3-9(7,8)4-5(2)6/h3,5-6H,1,4H2,2H3
InChIKeyLBKZKSWKRXFZLR-UHFFFAOYSA-N
XLogP-0.07
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.20
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-ethenylsulfonylpropan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethenylsulfonylpropan-2-ol?
The IUPAC name of 1-ethenylsulfonylpropan-2-ol (CID 19808252) is 1-ethenylsulfonylpropan-2-ol.
What is the SMILES notation for 1-ethenylsulfonylpropan-2-ol?
The canonical SMILES for 1-ethenylsulfonylpropan-2-ol is C=CS(=O)(=O)CC(C)O.
What is the InChIKey of 1-ethenylsulfonylpropan-2-ol?
The InChIKey is LBKZKSWKRXFZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O3S/c1-3-9(7,8)4-5(2)6/h3,5-6H,1,4H2,2H3.
What are the key properties of 1-ethenylsulfonylpropan-2-ol?
1-ethenylsulfonylpropan-2-ol has a molecular weight of 150.20 g/mol, XLogP of -0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylsulfonylpropan-2-ol is sourced from PubChem (CID 19808252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).