Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane

C18H24P2 — CID 22760091

IUPACethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane
SMILESCCP(CCP(CC)C1=CC=CC=C1)C2=CC=CC=C2
InChIInChI=1S/C18H24P2/c1-3-19(17-11-7-5-8-12-17)15-16-20(4-2)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKeyCJHSDHBPSJSNOW-UHFFFAOYSA-N
MW302.30 g/mol
LogP3.50
Rot. Bonds7

About Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane

Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane (PubChem CID 22760091) has the molecular formula C18H24P2 and a molecular weight of 302.30 g/mol. Its IUPAC name is ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane.

Molecular Properties

Compound NameEthyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane
PubChem CID22760091
Molecular FormulaC18H24P2
Molecular Weight302.30 g/mol
Exact Mass302.14
IUPAC Nameethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane
SMILESCCP(CCP(CC)C1=CC=CC=C1)C2=CC=CC=C2
InChIInChI=1S/C18H24P2/c1-3-19(17-11-7-5-8-12-17)15-16-20(4-2)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3
InChIKeyCJHSDHBPSJSNOW-UHFFFAOYSA-N
XLogP3.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms20
Complexity216

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.30
LogP ≤ 53.50
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-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane?
The IUPAC name of Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane (CID 22760091) is ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane.
What is the SMILES notation for Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane?
The canonical SMILES for Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane is CCP(CCP(CC)C1=CC=CC=C1)C2=CC=CC=C2.
What is the InChIKey of Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane?
The InChIKey is CJHSDHBPSJSNOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24P2/c1-3-19(17-11-7-5-8-12-17)15-16-20(4-2)18-13-9-6-10-14-18/h5-14H,3-4,15-16H2,1-2H3.
What are the key properties of Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane?
Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane has a molecular weight of 302.30 g/mol, XLogP of 3.50, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Ethyl-[2-[ethyl(phenyl)phosphanyl]ethyl]-phenylphosphane is sourced from PubChem (CID 22760091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).