1-[ethenyl(methoxy)phosphoryl]ethane

C5H11O2P — CID 71444653

IUPAC1-[ethenyl(methoxy)phosphoryl]ethane
SMILESC=CP(=O)(CC)OC
InChIInChI=1S/C5H11O2P/c1-4-8(6,5-2)7-3/h4H,1,5H2,2-3H3
InChIKeyHOWJBFZFFAOREF-UHFFFAOYSA-N
MW134.11 g/mol
LogP2.07
Rot. Bonds3

About 1-[ethenyl(methoxy)phosphoryl]ethane

1-[ethenyl(methoxy)phosphoryl]ethane (PubChem CID 71444653) has the molecular formula C5H11O2P and a molecular weight of 134.11 g/mol. Its IUPAC name is 1-[ethenyl(methoxy)phosphoryl]ethane.

Molecular Properties

Compound Name1-[ethenyl(methoxy)phosphoryl]ethane
PubChem CID71444653
Molecular FormulaC5H11O2P
Molecular Weight134.11 g/mol
Exact Mass134.05
IUPAC Name1-[ethenyl(methoxy)phosphoryl]ethane
SMILESC=CP(=O)(CC)OC
InChIInChI=1S/C5H11O2P/c1-4-8(6,5-2)7-3/h4H,1,5H2,2-3H3
InChIKeyHOWJBFZFFAOREF-UHFFFAOYSA-N
XLogP2.07
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.11
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[ethenyl(methoxy)phosphoryl]ethane 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(methoxy)phosphoryl]ethane?
The IUPAC name of 1-[ethenyl(methoxy)phosphoryl]ethane (CID 71444653) is 1-[ethenyl(methoxy)phosphoryl]ethane.
What is the SMILES notation for 1-[ethenyl(methoxy)phosphoryl]ethane?
The canonical SMILES for 1-[ethenyl(methoxy)phosphoryl]ethane is C=CP(=O)(CC)OC.
What is the InChIKey of 1-[ethenyl(methoxy)phosphoryl]ethane?
The InChIKey is HOWJBFZFFAOREF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11O2P/c1-4-8(6,5-2)7-3/h4H,1,5H2,2-3H3.
What are the key properties of 1-[ethenyl(methoxy)phosphoryl]ethane?
1-[ethenyl(methoxy)phosphoryl]ethane has a molecular weight of 134.11 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethenyl(methoxy)phosphoryl]ethane is sourced from PubChem (CID 71444653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).