1-bis(ethenyl)phosphoryloxyethene

C6H9O2P — CID 87155072

IUPAC1-bis(ethenyl)phosphoryloxyethene
SMILESC=COP(=O)(C=C)C=C
InChIInChI=1S/C6H9O2P/c1-4-8-9(7,5-2)6-3/h4-6H,1-3H2
InChIKeyYAEAMVYRJHAXSU-UHFFFAOYSA-N
MW144.11 g/mol
LogP2.71
Rot. Bonds4

About 1-bis(ethenyl)phosphoryloxyethene

1-bis(ethenyl)phosphoryloxyethene (PubChem CID 87155072) has the molecular formula C6H9O2P and a molecular weight of 144.11 g/mol. Its IUPAC name is 1-bis(ethenyl)phosphoryloxyethene.

Molecular Properties

Compound Name1-bis(ethenyl)phosphoryloxyethene
PubChem CID87155072
Molecular FormulaC6H9O2P
Molecular Weight144.11 g/mol
Exact Mass144.03
IUPAC Name1-bis(ethenyl)phosphoryloxyethene
SMILESC=COP(=O)(C=C)C=C
InChIInChI=1S/C6H9O2P/c1-4-8-9(7,5-2)6-3/h4-6H,1-3H2
InChIKeyYAEAMVYRJHAXSU-UHFFFAOYSA-N
XLogP2.71
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.11
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-bis(ethenyl)phosphoryloxyethene?
The IUPAC name of 1-bis(ethenyl)phosphoryloxyethene (CID 87155072) is 1-bis(ethenyl)phosphoryloxyethene.
What is the SMILES notation for 1-bis(ethenyl)phosphoryloxyethene?
The canonical SMILES for 1-bis(ethenyl)phosphoryloxyethene is C=COP(=O)(C=C)C=C.
What is the InChIKey of 1-bis(ethenyl)phosphoryloxyethene?
The InChIKey is YAEAMVYRJHAXSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9O2P/c1-4-8-9(7,5-2)6-3/h4-6H,1-3H2.
What are the key properties of 1-bis(ethenyl)phosphoryloxyethene?
1-bis(ethenyl)phosphoryloxyethene has a molecular weight of 144.11 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bis(ethenyl)phosphoryloxyethene is sourced from PubChem (CID 87155072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).