methyl(tetraphenoxy)-lambda5-phosphane

C25H23O4P — CID 14294612

IUPACmethyl(tetraphenoxy)-lambda5-phosphane
SMILESCP(Oc1ccccc1)(Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C25H23O4P/c1-30(26-22-14-6-2-7-15-22,27-23-16-8-3-9-17-23,28-24-18-10-4-11-19-24)29-25-20-12-5-13-21-25/h2-21H,1H3
InChIKeyCGBRVQPRWXIQTA-UHFFFAOYSA-N
MW418.43 g/mol
LogP7.15
Rot. Bonds8

About methyl(tetraphenoxy)-lambda5-phosphane

methyl(tetraphenoxy)-lambda5-phosphane (PubChem CID 14294612) has the molecular formula C25H23O4P and a molecular weight of 418.43 g/mol. Its IUPAC name is methyl(tetraphenoxy)-lambda5-phosphane.

Molecular Properties

Compound Namemethyl(tetraphenoxy)-lambda5-phosphane
PubChem CID14294612
Molecular FormulaC25H23O4P
Molecular Weight418.43 g/mol
Exact Mass418.13
IUPAC Namemethyl(tetraphenoxy)-lambda5-phosphane
SMILESCP(Oc1ccccc1)(Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C25H23O4P/c1-30(26-22-14-6-2-7-15-22,27-23-16-8-3-9-17-23,28-24-18-10-4-11-19-24)29-25-20-12-5-13-21-25/h2-21H,1H3
InChIKeyCGBRVQPRWXIQTA-UHFFFAOYSA-N
XLogP7.15
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.43
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze methyl(tetraphenoxy)-lambda5-phosphane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl(tetraphenoxy)-lambda5-phosphane?
The IUPAC name of methyl(tetraphenoxy)-lambda5-phosphane (CID 14294612) is methyl(tetraphenoxy)-lambda5-phosphane.
What is the SMILES notation for methyl(tetraphenoxy)-lambda5-phosphane?
The canonical SMILES for methyl(tetraphenoxy)-lambda5-phosphane is CP(Oc1ccccc1)(Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of methyl(tetraphenoxy)-lambda5-phosphane?
The InChIKey is CGBRVQPRWXIQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23O4P/c1-30(26-22-14-6-2-7-15-22,27-23-16-8-3-9-17-23,28-24-18-10-4-11-19-24)29-25-20-12-5-13-21-25/h2-21H,1H3.
What are the key properties of methyl(tetraphenoxy)-lambda5-phosphane?
methyl(tetraphenoxy)-lambda5-phosphane has a molecular weight of 418.43 g/mol, XLogP of 7.15, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(tetraphenoxy)-lambda5-phosphane is sourced from PubChem (CID 14294612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).