phenoxymethylidene(triphenyl)-λ5-phosphane

C25H21OP — CID 21329537

IUPACphenoxymethylidene(triphenyl)-λ5-phosphane
SMILESC(Oc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H21OP/c1-5-13-22(14-6-1)26-21-27(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H
InChIKeyOUQZETDZCSDWSF-UHFFFAOYSA-N
MW368.42 g/mol
LogP4.82
Rot. Bonds5

About phenoxymethylidene(triphenyl)-λ5-phosphane

phenoxymethylidene(triphenyl)-λ5-phosphane (PubChem CID 21329537) has the molecular formula C25H21OP and a molecular weight of 368.42 g/mol. Its IUPAC name is phenoxymethylidene(triphenyl)-λ5-phosphane.

Molecular Properties

Compound Namephenoxymethylidene(triphenyl)-λ5-phosphane
PubChem CID21329537
Molecular FormulaC25H21OP
Molecular Weight368.42 g/mol
Exact Mass368.13
IUPAC Namephenoxymethylidene(triphenyl)-λ5-phosphane
SMILESC(Oc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H21OP/c1-5-13-22(14-6-1)26-21-27(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H
InChIKeyOUQZETDZCSDWSF-UHFFFAOYSA-N
XLogP4.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.42
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phenoxymethylidene(triphenyl)-λ5-phosphane?
The IUPAC name of phenoxymethylidene(triphenyl)-λ5-phosphane (CID 21329537) is phenoxymethylidene(triphenyl)-λ5-phosphane.
What is the SMILES notation for phenoxymethylidene(triphenyl)-λ5-phosphane?
The canonical SMILES for phenoxymethylidene(triphenyl)-λ5-phosphane is C(Oc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of phenoxymethylidene(triphenyl)-λ5-phosphane?
The InChIKey is OUQZETDZCSDWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21OP/c1-5-13-22(14-6-1)26-21-27(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H.
What are the key properties of phenoxymethylidene(triphenyl)-λ5-phosphane?
phenoxymethylidene(triphenyl)-λ5-phosphane has a molecular weight of 368.42 g/mol, XLogP of 4.82, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenoxymethylidene(triphenyl)-λ5-phosphane is sourced from PubChem (CID 21329537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).