1-[ethyl(fluoro)phosphoryl]oxyethane

C4H10FO2P — CID 522151

IUPAC1-[ethyl(fluoro)phosphoryl]oxyethane
SMILESCCOP(=O)(F)CC
InChIInChI=1S/C4H10FO2P/c1-3-7-8(5,6)4-2/h3-4H2,1-2H3
InChIKeyRORQVZRCLFKMMP-UHFFFAOYSA-N
MW140.09 g/mol
LogP2.21
Rot. Bonds3

About 1-[ethyl(fluoro)phosphoryl]oxyethane

1-[ethyl(fluoro)phosphoryl]oxyethane (PubChem CID 522151) has the molecular formula C4H10FO2P and a molecular weight of 140.09 g/mol. Its IUPAC name is 1-[ethyl(fluoro)phosphoryl]oxyethane.

Molecular Properties

Compound Name1-[ethyl(fluoro)phosphoryl]oxyethane
PubChem CID522151
Molecular FormulaC4H10FO2P
Molecular Weight140.09 g/mol
Exact Mass140.04
IUPAC Name1-[ethyl(fluoro)phosphoryl]oxyethane
SMILESCCOP(=O)(F)CC
InChIInChI=1S/C4H10FO2P/c1-3-7-8(5,6)4-2/h3-4H2,1-2H3
InChIKeyRORQVZRCLFKMMP-UHFFFAOYSA-N
XLogP2.21
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.09
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[ethyl(fluoro)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-[ethyl(fluoro)phosphoryl]oxyethane?
The IUPAC name of 1-[ethyl(fluoro)phosphoryl]oxyethane (CID 522151) is 1-[ethyl(fluoro)phosphoryl]oxyethane.
What is the SMILES notation for 1-[ethyl(fluoro)phosphoryl]oxyethane?
The canonical SMILES for 1-[ethyl(fluoro)phosphoryl]oxyethane is CCOP(=O)(F)CC.
What is the InChIKey of 1-[ethyl(fluoro)phosphoryl]oxyethane?
The InChIKey is RORQVZRCLFKMMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FO2P/c1-3-7-8(5,6)4-2/h3-4H2,1-2H3.
What are the key properties of 1-[ethyl(fluoro)phosphoryl]oxyethane?
1-[ethyl(fluoro)phosphoryl]oxyethane has a molecular weight of 140.09 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(fluoro)phosphoryl]oxyethane is sourced from PubChem (CID 522151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).