ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane

C27H23P — CID 10959810

IUPACethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane
SMILESCCP(=C1c2ccccc2-c2ccccc21)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H23P/c1-2-28(21-13-5-3-6-14-21,22-15-7-4-8-16-22)27-25-19-11-9-17-23(25)24-18-10-12-20-26(24)27/h3-20H,2H2,1H3
InChIKeyAUNXYNREJCEVGS-UHFFFAOYSA-N
MW378.46 g/mol
LogP5.92
Rot. Bonds3

About ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane

ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane (PubChem CID 10959810) has the molecular formula C27H23P and a molecular weight of 378.46 g/mol. Its IUPAC name is ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane.

Molecular Properties

Compound Nameethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane
PubChem CID10959810
Molecular FormulaC27H23P
Molecular Weight378.46 g/mol
Exact Mass378.15
IUPAC Nameethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane
SMILESCCP(=C1c2ccccc2-c2ccccc21)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H23P/c1-2-28(21-13-5-3-6-14-21,22-15-7-4-8-16-22)27-25-19-11-9-17-23(25)24-18-10-12-20-26(24)27/h3-20H,2H2,1H3
InChIKeyAUNXYNREJCEVGS-UHFFFAOYSA-N
XLogP5.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.46
LogP ≤ 55.92
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 ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane?
The IUPAC name of ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane (CID 10959810) is ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane.
What is the SMILES notation for ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane?
The canonical SMILES for ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane is CCP(=C1c2ccccc2-c2ccccc21)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane?
The InChIKey is AUNXYNREJCEVGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23P/c1-2-28(21-13-5-3-6-14-21,22-15-7-4-8-16-22)27-25-19-11-9-17-23(25)24-18-10-12-20-26(24)27/h3-20H,2H2,1H3.
What are the key properties of ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane?
ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane has a molecular weight of 378.46 g/mol, XLogP of 5.92, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-fluoren-9-ylidene-diphenyl-λ5-phosphane is sourced from PubChem (CID 10959810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).