bis(ethenyl) phenyl phosphate

C10H11O4P — CID 22119346

IUPACbis(ethenyl) phenyl phosphate
SMILESC=COP(=O)(OC=C)Oc1ccccc1
InChIInChI=1S/C10H11O4P/c1-3-12-15(11,13-4-2)14-10-8-6-5-7-9-10/h3-9H,1-2H2
InChIKeyHVZZOPZLPHALDI-UHFFFAOYSA-N
MW226.17 g/mol
LogP3.49
Rot. Bonds6

About bis(ethenyl) phenyl phosphate

bis(ethenyl) phenyl phosphate (PubChem CID 22119346) has the molecular formula C10H11O4P and a molecular weight of 226.17 g/mol. Its IUPAC name is bis(ethenyl) phenyl phosphate.

Molecular Properties

Compound Namebis(ethenyl) phenyl phosphate
PubChem CID22119346
Molecular FormulaC10H11O4P
Molecular Weight226.17 g/mol
Exact Mass226.04
IUPAC Namebis(ethenyl) phenyl phosphate
SMILESC=COP(=O)(OC=C)Oc1ccccc1
InChIInChI=1S/C10H11O4P/c1-3-12-15(11,13-4-2)14-10-8-6-5-7-9-10/h3-9H,1-2H2
InChIKeyHVZZOPZLPHALDI-UHFFFAOYSA-N
XLogP3.49
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.17
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze bis(ethenyl) phenyl phosphate 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

ethenyl methyl phenyl phosphate
CID 11593721
triphenyl phosphate;hydrate
CID 66881958
bis(4-diphenoxyphosphoryloxyphenyl) phenyl phosphate
CID 58066863
CID 175741196
CID 175741196
diphenyl silyl phosphate
CID 71371486
tris(4-phenoxyphenyl) phosphate
CID 70576220
2-methylpropane;triphenyl phosphate
CID 91193965
benzyl bis(ethenyl) phosphate
CID 141056267
[4-(1-hydroxyprop-2-enyl)phenyl] diphenyl phosphate
CID 67678043
chloro diphenyl phosphate;hydrate
CID 70610879
phenyl phosphono prop-2-enyl phosphate
CID 88721079
[methyl(diphenoxy)-λ5-phosphanylidene]azanide;yttrium
CID 58152781

Frequently Asked Questions

What is the IUPAC name of bis(ethenyl) phenyl phosphate?
The IUPAC name of bis(ethenyl) phenyl phosphate (CID 22119346) is bis(ethenyl) phenyl phosphate.
What is the SMILES notation for bis(ethenyl) phenyl phosphate?
The canonical SMILES for bis(ethenyl) phenyl phosphate is C=COP(=O)(OC=C)Oc1ccccc1.
What is the InChIKey of bis(ethenyl) phenyl phosphate?
The InChIKey is HVZZOPZLPHALDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11O4P/c1-3-12-15(11,13-4-2)14-10-8-6-5-7-9-10/h3-9H,1-2H2.
What are the key properties of bis(ethenyl) phenyl phosphate?
bis(ethenyl) phenyl phosphate has a molecular weight of 226.17 g/mol, XLogP of 3.49, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethenyl) phenyl phosphate is sourced from PubChem (CID 22119346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).