2-(2-ethenylsulfonylethoxy)ethanol

C6H12O4S — CID 118674332

IUPAC2-(2-ethenylsulfonylethoxy)ethanol
SMILESC=CS(=O)(=O)CCOCCO
InChIInChI=1S/C6H12O4S/c1-2-11(8,9)6-5-10-4-3-7/h2,7H,1,3-6H2
InChIKeyDIRQYKZILKBYIN-UHFFFAOYSA-N
MW180.22 g/mol
LogP-0.45
Rot. Bonds6

About 2-(2-ethenylsulfonylethoxy)ethanol

2-(2-ethenylsulfonylethoxy)ethanol (PubChem CID 118674332) has the molecular formula C6H12O4S and a molecular weight of 180.22 g/mol. Its IUPAC name is 2-(2-ethenylsulfonylethoxy)ethanol.

Molecular Properties

Compound Name2-(2-ethenylsulfonylethoxy)ethanol
PubChem CID118674332
Molecular FormulaC6H12O4S
Molecular Weight180.22 g/mol
Exact Mass180.05
IUPAC Name2-(2-ethenylsulfonylethoxy)ethanol
SMILESC=CS(=O)(=O)CCOCCO
InChIInChI=1S/C6H12O4S/c1-2-11(8,9)6-5-10-4-3-7/h2,7H,1,3-6H2
InChIKeyDIRQYKZILKBYIN-UHFFFAOYSA-N
XLogP-0.45
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(2-ethenylsulfonylethoxy)ethanol with MolForge

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

Launch Full Analysis

Related Compounds

2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol;sulfuric acid
CID 88726836
CID 44818876
CID 44818876
2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)
CID 161223084
1-(ethenylsulfonylmethoxy)-2-[2-(ethenylsulfonylmethoxy)ethoxy]ethane
CID 71341054
tris(2-(2-hydroxyethoxy)ethanol);prop-2-enoic acid
CID 173161681
2-ethenylsulfonylethoxymethylbenzene
CID 5141696
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;prop-2-enoic acid
CID 88626214
2-(2-ethenylsulfonylethylamino)ethanol
CID 170994320
2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;methanesulfonic acid
CID 87626226
2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619769
2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619770
2-[2-(2-propylsulfonylethoxy)ethoxy]ethanol
CID 58517140

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethenylsulfonylethoxy)ethanol?
The IUPAC name of 2-(2-ethenylsulfonylethoxy)ethanol (CID 118674332) is 2-(2-ethenylsulfonylethoxy)ethanol.
What is the SMILES notation for 2-(2-ethenylsulfonylethoxy)ethanol?
The canonical SMILES for 2-(2-ethenylsulfonylethoxy)ethanol is C=CS(=O)(=O)CCOCCO.
What is the InChIKey of 2-(2-ethenylsulfonylethoxy)ethanol?
The InChIKey is DIRQYKZILKBYIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O4S/c1-2-11(8,9)6-5-10-4-3-7/h2,7H,1,3-6H2.
What are the key properties of 2-(2-ethenylsulfonylethoxy)ethanol?
2-(2-ethenylsulfonylethoxy)ethanol has a molecular weight of 180.22 g/mol, XLogP of -0.45, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethenylsulfonylethoxy)ethanol is sourced from PubChem (CID 118674332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).