ethenyl(prop-2-enoxy)phosphinate

C5H8O3P- — CID 71349552

IUPACethenyl(prop-2-enoxy)phosphinate
SMILESC=CCOP(=O)([O-])C=C
InChIInChI=1S/C5H9O3P/c1-3-5-8-9(6,7)4-2/h3-4H,1-2,5H2,(H,6,7)/p-1
InChIKeyHNXGIBKLRYVYLZ-UHFFFAOYSA-M
MW147.09 g/mol
LogP0.89
Rot. Bonds4

About ethenyl(prop-2-enoxy)phosphinate

ethenyl(prop-2-enoxy)phosphinate (PubChem CID 71349552) has the molecular formula C5H8O3P- and a molecular weight of 147.09 g/mol. Its IUPAC name is ethenyl(prop-2-enoxy)phosphinate.

Molecular Properties

Compound Nameethenyl(prop-2-enoxy)phosphinate
PubChem CID71349552
Molecular FormulaC5H8O3P-
Molecular Weight147.09 g/mol
Exact Mass147.02
IUPAC Nameethenyl(prop-2-enoxy)phosphinate
SMILESC=CCOP(=O)([O-])C=C
InChIInChI=1S/C5H9O3P/c1-3-5-8-9(6,7)4-2/h3-4H,1-2,5H2,(H,6,7)/p-1
InChIKeyHNXGIBKLRYVYLZ-UHFFFAOYSA-M
XLogP0.89
TPSA49.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.09
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

disodium;prop-2-enyl phosphate
CID 87157623
zinc prop-2-enyl phosphate
CID 87515855
zinc [oxido(prop-2-enoxy)phosphoryl] prop-2-enyl phosphate
CID 88639643
disodium bis(carboxy(prop-2-enoxy)phosphinate)
CID 173451662
3-[ethenoxy(ethenyl)phosphoryl]oxyprop-1-ene
CID 175157966
methane;prop-2-enyl dihydrogen phosphate
CID 87755414
prop-2-enyl 2-(trimethylazaniumyl)ethyl phosphate
CID 11535902
bis(oxido-prop-2-enoxy-sulfanylidene-sulfido-λ5-phosphane);titanium(4+)
CID 87309852
iron(2+);oxido-prop-2-enoxy-sulfanylidene-sulfido-λ5-phosphane
CID 87288661
azane;methyl bis(prop-2-enyl) phosphate
CID 174513624
N-[[bis(prop-2-enyl)amino]-prop-2-enoxyphosphoryl]-N-prop-2-enylprop-2-en-1-amine
CID 88513081
trisodium;hydride;phosphoric acid;prop-2-enyl dihydrogen phosphate
CID 174828958

Frequently Asked Questions

What is the IUPAC name of ethenyl(prop-2-enoxy)phosphinate?
The IUPAC name of ethenyl(prop-2-enoxy)phosphinate (CID 71349552) is ethenyl(prop-2-enoxy)phosphinate.
What is the SMILES notation for ethenyl(prop-2-enoxy)phosphinate?
The canonical SMILES for ethenyl(prop-2-enoxy)phosphinate is C=CCOP(=O)([O-])C=C.
What is the InChIKey of ethenyl(prop-2-enoxy)phosphinate?
The InChIKey is HNXGIBKLRYVYLZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H9O3P/c1-3-5-8-9(6,7)4-2/h3-4H,1-2,5H2,(H,6,7)/p-1.
What are the key properties of ethenyl(prop-2-enoxy)phosphinate?
ethenyl(prop-2-enoxy)phosphinate has a molecular weight of 147.09 g/mol, XLogP of 0.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl(prop-2-enoxy)phosphinate is sourced from PubChem (CID 71349552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).