dicyclohexyl(propyl)phosphane

C15H29P — CID 12793992

IUPACdicyclohexyl(propyl)phosphane
SMILESCCCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C15H29P/c1-2-13-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h14-15H,2-13H2,1H3
InChIKeyNYROBDNMXCGUIR-UHFFFAOYSA-N
MW240.37 g/mol
LogP5.54
Rot. Bonds4

About dicyclohexyl(propyl)phosphane

dicyclohexyl(propyl)phosphane (PubChem CID 12793992) has the molecular formula C15H29P and a molecular weight of 240.37 g/mol. Its IUPAC name is dicyclohexyl(propyl)phosphane.

Molecular Properties

Compound Namedicyclohexyl(propyl)phosphane
PubChem CID12793992
Molecular FormulaC15H29P
Molecular Weight240.37 g/mol
Exact Mass240.20
IUPAC Namedicyclohexyl(propyl)phosphane
SMILESCCCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C15H29P/c1-2-13-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h14-15H,2-13H2,1H3
InChIKeyNYROBDNMXCGUIR-UHFFFAOYSA-N
XLogP5.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.37
LogP ≤ 55.54
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 dicyclohexyl(propyl)phosphane?
The IUPAC name of dicyclohexyl(propyl)phosphane (CID 12793992) is dicyclohexyl(propyl)phosphane.
What is the SMILES notation for dicyclohexyl(propyl)phosphane?
The canonical SMILES for dicyclohexyl(propyl)phosphane is CCCP(C1CCCCC1)C1CCCCC1.
What is the InChIKey of dicyclohexyl(propyl)phosphane?
The InChIKey is NYROBDNMXCGUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29P/c1-2-13-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h14-15H,2-13H2,1H3.
What are the key properties of dicyclohexyl(propyl)phosphane?
dicyclohexyl(propyl)phosphane has a molecular weight of 240.37 g/mol, XLogP of 5.54, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexyl(propyl)phosphane is sourced from PubChem (CID 12793992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).