cyclobutylmethylidene(triphenyl)-lambda5-phosphane

C23H23P — CID 14064940

IUPACcyclobutylmethylidene(triphenyl)-lambda5-phosphane
SMILESC(C1CCC1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23P/c1-4-13-21(14-5-1)24(19-20-11-10-12-20,22-15-6-2-7-16-22)23-17-8-3-9-18-23/h1-9,13-20H,10-12H2
InChIKeyPJRGLTWXHFTDFB-UHFFFAOYSA-N
MW330.41 g/mol
LogP4.58
Rot. Bonds4

About cyclobutylmethylidene(triphenyl)-lambda5-phosphane

cyclobutylmethylidene(triphenyl)-lambda5-phosphane (PubChem CID 14064940) has the molecular formula C23H23P and a molecular weight of 330.41 g/mol. Its IUPAC name is cyclobutylmethylidene(triphenyl)-lambda5-phosphane.

Molecular Properties

Compound Namecyclobutylmethylidene(triphenyl)-lambda5-phosphane
PubChem CID14064940
Molecular FormulaC23H23P
Molecular Weight330.41 g/mol
Exact Mass330.15
IUPAC Namecyclobutylmethylidene(triphenyl)-lambda5-phosphane
SMILESC(C1CCC1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23P/c1-4-13-21(14-5-1)24(19-20-11-10-12-20,22-15-6-2-7-16-22)23-17-8-3-9-18-23/h1-9,13-20H,10-12H2
InChIKeyPJRGLTWXHFTDFB-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclobutylmethylidene(triphenyl)-lambda5-phosphane?
The IUPAC name of cyclobutylmethylidene(triphenyl)-lambda5-phosphane (CID 14064940) is cyclobutylmethylidene(triphenyl)-lambda5-phosphane.
What is the SMILES notation for cyclobutylmethylidene(triphenyl)-lambda5-phosphane?
The canonical SMILES for cyclobutylmethylidene(triphenyl)-lambda5-phosphane is C(C1CCC1)=P(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of cyclobutylmethylidene(triphenyl)-lambda5-phosphane?
The InChIKey is PJRGLTWXHFTDFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23P/c1-4-13-21(14-5-1)24(19-20-11-10-12-20,22-15-6-2-7-16-22)23-17-8-3-9-18-23/h1-9,13-20H,10-12H2.
What are the key properties of cyclobutylmethylidene(triphenyl)-lambda5-phosphane?
cyclobutylmethylidene(triphenyl)-lambda5-phosphane has a molecular weight of 330.41 g/mol, XLogP of 4.58, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutylmethylidene(triphenyl)-lambda5-phosphane is sourced from PubChem (CID 14064940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).