triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane

C28H25P — CID 12872259

IUPACtriphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane
SMILESCC(/C=C/c1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H25P/c1-24(22-23-25-14-6-2-7-15-25)29(26-16-8-3-9-17-26,27-18-10-4-11-19-27)28-20-12-5-13-21-28/h2-23H,1H3/b23-22+
InChIKeyROLWYNUFULETHI-GHVJWSGMSA-N
MW392.48 g/mol
LogP5.89
Rot. Bonds5

About triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane

triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane (PubChem CID 12872259) has the molecular formula C28H25P and a molecular weight of 392.48 g/mol. Its IUPAC name is triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane.

Molecular Properties

Compound Nametriphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane
PubChem CID12872259
Molecular FormulaC28H25P
Molecular Weight392.48 g/mol
Exact Mass392.17
IUPAC Nametriphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane
SMILESCC(/C=C/c1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H25P/c1-24(22-23-25-14-6-2-7-15-25)29(26-16-8-3-9-17-26,27-18-10-4-11-19-27)28-20-12-5-13-21-28/h2-23H,1H3/b23-22+
InChIKeyROLWYNUFULETHI-GHVJWSGMSA-N
XLogP5.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.48
LogP ≤ 55.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(4E)-1,5-diphenylpenta-1,4-dien-3-one;propan-2-one
CID 158678637
(E)-[(Z)-4-phenylbut-3-en-2-ylidene]hydrazine
CID 92531836
(NE)-N-(4-phenylbut-3-en-2-ylidene)hydroxylamine
CID 6738838
N-methyl-4-phenylbut-3-en-2-imine
CID 15325561
(Z)-[(Z)-4-phenylbut-3-en-2-ylidene]hydrazine
CID 92531835
acetic acid;stilbene
CID 172803728
(E)-3-phenyl-N-(triphenyl-λ5-phosphanylidene)prop-2-enamide
CID 134920511
(3-methyl-6-phenylhexa-1,3,5-trienyl)benzene
CID 618811
(1Z,3Z)-N,2-dimethyl-4-phenylbuta-1,3-dien-1-amine
CID 166740915
(1E,4E)-N-[(E)-but-2-en-2-yl]-1,5-diphenylpenta-1,4-dien-3-imine oxide
CID 134846081
[(1E,3E,5Z)-3-methylocta-1,3,5,7-tetraenyl]benzene
CID 143083537
(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one
CID 157206787

Frequently Asked Questions

What is the IUPAC name of triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane?
The IUPAC name of triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane (CID 12872259) is triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane.
What is the SMILES notation for triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane?
The canonical SMILES for triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane is CC(/C=C/c1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane?
The InChIKey is ROLWYNUFULETHI-GHVJWSGMSA-N. The full InChI is InChI=1S/C28H25P/c1-24(22-23-25-14-6-2-7-15-25)29(26-16-8-3-9-17-26,27-18-10-4-11-19-27)28-20-12-5-13-21-28/h2-23H,1H3/b23-22+.
What are the key properties of triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane?
triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane has a molecular weight of 392.48 g/mol, XLogP of 5.89, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[(E)-4-phenylbut-3-en-2-ylidene]-lambda5-phosphane is sourced from PubChem (CID 12872259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).