1-[chloro(ethenyl)phosphoryl]oxyethane

C4H8ClO2P — CID 12673186

IUPAC1-[chloro(ethenyl)phosphoryl]oxyethane
SMILESC=CP(=O)(Cl)OCC
InChIInChI=1S/C4H8ClO2P/c1-3-7-8(5,6)4-2/h4H,2-3H2,1H3
InChIKeyVIYAGAKENXYSOL-UHFFFAOYSA-N
MW154.53 g/mol
LogP2.60
Rot. Bonds3

About 1-[chloro(ethenyl)phosphoryl]oxyethane

1-[chloro(ethenyl)phosphoryl]oxyethane (PubChem CID 12673186) has the molecular formula C4H8ClO2P and a molecular weight of 154.53 g/mol. Its IUPAC name is 1-[chloro(ethenyl)phosphoryl]oxyethane.

Molecular Properties

Compound Name1-[chloro(ethenyl)phosphoryl]oxyethane
PubChem CID12673186
Molecular FormulaC4H8ClO2P
Molecular Weight154.53 g/mol
Exact Mass154.00
IUPAC Name1-[chloro(ethenyl)phosphoryl]oxyethane
SMILESC=CP(=O)(Cl)OCC
InChIInChI=1S/C4H8ClO2P/c1-3-7-8(5,6)4-2/h4H,2-3H2,1H3
InChIKeyVIYAGAKENXYSOL-UHFFFAOYSA-N
XLogP2.60
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.53
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[chloro(ethenyl)phosphoryl]oxyethane?
The IUPAC name of 1-[chloro(ethenyl)phosphoryl]oxyethane (CID 12673186) is 1-[chloro(ethenyl)phosphoryl]oxyethane.
What is the SMILES notation for 1-[chloro(ethenyl)phosphoryl]oxyethane?
The canonical SMILES for 1-[chloro(ethenyl)phosphoryl]oxyethane is C=CP(=O)(Cl)OCC.
What is the InChIKey of 1-[chloro(ethenyl)phosphoryl]oxyethane?
The InChIKey is VIYAGAKENXYSOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8ClO2P/c1-3-7-8(5,6)4-2/h4H,2-3H2,1H3.
What are the key properties of 1-[chloro(ethenyl)phosphoryl]oxyethane?
1-[chloro(ethenyl)phosphoryl]oxyethane has a molecular weight of 154.53 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[chloro(ethenyl)phosphoryl]oxyethane is sourced from PubChem (CID 12673186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).