1-[ethenyl(ethyl)phosphoryl]oxyethane

C6H13O2P — CID 23415794

IUPAC1-[ethenyl(ethyl)phosphoryl]oxyethane
SMILESC=CP(=O)(CC)OCC
InChIInChI=1S/C6H13O2P/c1-4-8-9(7,5-2)6-3/h5H,2,4,6H2,1,3H3
InChIKeyRICMJEFNBRXIAY-UHFFFAOYSA-N
MW148.14 g/mol
LogP2.46
Rot. Bonds4

About 1-[ethenyl(ethyl)phosphoryl]oxyethane

1-[ethenyl(ethyl)phosphoryl]oxyethane (PubChem CID 23415794) has the molecular formula C6H13O2P and a molecular weight of 148.14 g/mol. Its IUPAC name is 1-[ethenyl(ethyl)phosphoryl]oxyethane.

Molecular Properties

Compound Name1-[ethenyl(ethyl)phosphoryl]oxyethane
PubChem CID23415794
Molecular FormulaC6H13O2P
Molecular Weight148.14 g/mol
Exact Mass148.07
IUPAC Name1-[ethenyl(ethyl)phosphoryl]oxyethane
SMILESC=CP(=O)(CC)OCC
InChIInChI=1S/C6H13O2P/c1-4-8-9(7,5-2)6-3/h5H,2,4,6H2,1,3H3
InChIKeyRICMJEFNBRXIAY-UHFFFAOYSA-N
XLogP2.46
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.14
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[ethenyl(ethyl)phosphoryl]oxyethane 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-[ethenyl(ethyl)phosphoryl]oxyethane?
The IUPAC name of 1-[ethenyl(ethyl)phosphoryl]oxyethane (CID 23415794) is 1-[ethenyl(ethyl)phosphoryl]oxyethane.
What is the SMILES notation for 1-[ethenyl(ethyl)phosphoryl]oxyethane?
The canonical SMILES for 1-[ethenyl(ethyl)phosphoryl]oxyethane is C=CP(=O)(CC)OCC.
What is the InChIKey of 1-[ethenyl(ethyl)phosphoryl]oxyethane?
The InChIKey is RICMJEFNBRXIAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13O2P/c1-4-8-9(7,5-2)6-3/h5H,2,4,6H2,1,3H3.
What are the key properties of 1-[ethenyl(ethyl)phosphoryl]oxyethane?
1-[ethenyl(ethyl)phosphoryl]oxyethane has a molecular weight of 148.14 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethenyl(ethyl)phosphoryl]oxyethane is sourced from PubChem (CID 23415794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).