ethenylphosphonic acid;oxirane

C4H9O4P — CID 174918550

IUPACethenylphosphonic acid;oxirane
SMILESC1CO1.C=CP(=O)(O)O
InChIInChI=1S/C2H5O3P.C2H4O/c1-2-6(3,4)5;1-2-3-1/h2H,1H2,(H2,3,4,5);1-2H2
InChIKeyIEIUEIMPHRTKJA-UHFFFAOYSA-N
MW152.09 g/mol
LogP0.32
Rot. Bonds1

About ethenylphosphonic acid;oxirane

ethenylphosphonic acid;oxirane (PubChem CID 174918550) has the molecular formula C4H9O4P and a molecular weight of 152.09 g/mol. Its IUPAC name is ethenylphosphonic acid;oxirane.

Molecular Properties

Compound Nameethenylphosphonic acid;oxirane
PubChem CID174918550
Molecular FormulaC4H9O4P
Molecular Weight152.09 g/mol
Exact Mass152.02
IUPAC Nameethenylphosphonic acid;oxirane
SMILESC1CO1.C=CP(=O)(O)O
InChIInChI=1S/C2H5O3P.C2H4O/c1-2-6(3,4)5;1-2-3-1/h2H,1H2,(H2,3,4,5);1-2H2
InChIKeyIEIUEIMPHRTKJA-UHFFFAOYSA-N
XLogP0.32
TPSA70.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.09
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze ethenylphosphonic acid;oxirane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

oxirane;phosphoric acid;3-prop-2-enoxyprop-1-ene
CID 174429158
ethenylphosphonic acid;prop-2-enamide
CID 18401329
ethenylphosphonic acid;propane-1,3-diol
CID 159146855
ethenylphosphonic acid;2-methylidenepropanedioic acid
CID 123834959
oxirane;phosphono dihydrogen phosphate
CID 88636604
ethenyl(methoxy)phosphinic acid;ethenylphosphonic acid
CID 158810817
ethenylphosphonic acid;bis(N-ethylethanamine)
CID 174668506
ethenylphosphonic acid;trimethyl(prop-2-enyl)azanium
CID 87909379
oxirane;phosphoric acid;prop-2-enoxybenzene
CID 174439395
ethenylphosphonic acid;styrene
CID 67019440
oxirane;prop-2-en-1-ol;hydrate
CID 175380970
phosphoric acid;prop-1-ene
CID 175586036

Frequently Asked Questions

What is the IUPAC name of ethenylphosphonic acid;oxirane?
The IUPAC name of ethenylphosphonic acid;oxirane (CID 174918550) is ethenylphosphonic acid;oxirane.
What is the SMILES notation for ethenylphosphonic acid;oxirane?
The canonical SMILES for ethenylphosphonic acid;oxirane is C1CO1.C=CP(=O)(O)O.
What is the InChIKey of ethenylphosphonic acid;oxirane?
The InChIKey is IEIUEIMPHRTKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O3P.C2H4O/c1-2-6(3,4)5;1-2-3-1/h2H,1H2,(H2,3,4,5);1-2H2.
What are the key properties of ethenylphosphonic acid;oxirane?
ethenylphosphonic acid;oxirane has a molecular weight of 152.09 g/mol, XLogP of 0.32, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenylphosphonic acid;oxirane is sourced from PubChem (CID 174918550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).