phosphane;1,2,2-triphenylethenylbenzene

C26H23P — CID 157288563

IUPACphosphane;1,2,2-triphenylethenylbenzene
SMILESP.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H20.H3P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;1H3
InChIKeyVNKNFGJXGWDVCB-UHFFFAOYSA-N
MW366.44 g/mol
LogP6.75
Rot. Bonds4

About phosphane;1,2,2-triphenylethenylbenzene

phosphane;1,2,2-triphenylethenylbenzene (PubChem CID 157288563) has the molecular formula C26H23P and a molecular weight of 366.44 g/mol. Its IUPAC name is phosphane;1,2,2-triphenylethenylbenzene.

Molecular Properties

Compound Namephosphane;1,2,2-triphenylethenylbenzene
PubChem CID157288563
Molecular FormulaC26H23P
Molecular Weight366.44 g/mol
Exact Mass366.15
IUPAC Namephosphane;1,2,2-triphenylethenylbenzene
SMILESP.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H20.H3P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;1H3
InChIKeyVNKNFGJXGWDVCB-UHFFFAOYSA-N
XLogP6.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.44
LogP ≤ 56.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phosphane;1,2,2-triphenylethenylbenzene?
The IUPAC name of phosphane;1,2,2-triphenylethenylbenzene (CID 157288563) is phosphane;1,2,2-triphenylethenylbenzene.
What is the SMILES notation for phosphane;1,2,2-triphenylethenylbenzene?
The canonical SMILES for phosphane;1,2,2-triphenylethenylbenzene is P.c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of phosphane;1,2,2-triphenylethenylbenzene?
The InChIKey is VNKNFGJXGWDVCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20.H3P/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24;/h1-20H;1H3.
What are the key properties of phosphane;1,2,2-triphenylethenylbenzene?
phosphane;1,2,2-triphenylethenylbenzene has a molecular weight of 366.44 g/mol, XLogP of 6.75, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for phosphane;1,2,2-triphenylethenylbenzene is sourced from PubChem (CID 157288563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).