cyclohexyl-ethyl-octylphosphane

C16H33P — CID 90109221

IUPACcyclohexyl-ethyl-octylphosphane
SMILESCCCCCCCCP(CC)C1CCCCC1
InChIInChI=1S/C16H33P/c1-3-5-6-7-8-12-15-17(4-2)16-13-10-9-11-14-16/h16H,3-15H2,1-2H3
InChIKeyQVDIMMXFOPLFMU-UHFFFAOYSA-N
MW256.41 g/mol
LogP6.18
Rot. Bonds9

About cyclohexyl-ethyl-octylphosphane

cyclohexyl-ethyl-octylphosphane (PubChem CID 90109221) has the molecular formula C16H33P and a molecular weight of 256.41 g/mol. Its IUPAC name is cyclohexyl-ethyl-octylphosphane.

Molecular Properties

Compound Namecyclohexyl-ethyl-octylphosphane
PubChem CID90109221
Molecular FormulaC16H33P
Molecular Weight256.41 g/mol
Exact Mass256.23
IUPAC Namecyclohexyl-ethyl-octylphosphane
SMILESCCCCCCCCP(CC)C1CCCCC1
InChIInChI=1S/C16H33P/c1-3-5-6-7-8-12-15-17(4-2)16-13-10-9-11-14-16/h16H,3-15H2,1-2H3
InChIKeyQVDIMMXFOPLFMU-UHFFFAOYSA-N
XLogP6.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.41
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

cyclohexyl(diheptyl)phosphane
CID 118892787
dicyclohexyl-[[cyclohexyl(hexyl)phosphanyl]methyl]phosphane
CID 143925195
2-[cyclohexyl(heptyl)phosphanyl]-N-(2-dicyclohexylphosphanylethyl)ethanamine
CID 155183831
cyclopentyl(dipropyl)phosphane
CID 14322919
di(cyclobutyl)-octylphosphane
CID 151646814
cyclopentyl-octyl-propan-2-ylphosphane
CID 57115413
cis-(1R,2S)-1,2-dimethylcyclohexane;heptane
CID 142453951
butyl-cyclopentyl-methylphosphane
CID 155308845
cyclopropane;icosane
CID 162221728
cyclopropane;octadecane
CID 174865519
cyclohexyl-[4-[cyclohexyl(methyl)phosphanyl]butyl]-methylphosphane
CID 90057473
cyclopentyl-[[cyclopentyl(propyl)phosphanyl]methyl]-propylphosphane;dihydrobromide
CID 173222488

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-ethyl-octylphosphane?
The IUPAC name of cyclohexyl-ethyl-octylphosphane (CID 90109221) is cyclohexyl-ethyl-octylphosphane.
What is the SMILES notation for cyclohexyl-ethyl-octylphosphane?
The canonical SMILES for cyclohexyl-ethyl-octylphosphane is CCCCCCCCP(CC)C1CCCCC1.
What is the InChIKey of cyclohexyl-ethyl-octylphosphane?
The InChIKey is QVDIMMXFOPLFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33P/c1-3-5-6-7-8-12-15-17(4-2)16-13-10-9-11-14-16/h16H,3-15H2,1-2H3.
What are the key properties of cyclohexyl-ethyl-octylphosphane?
cyclohexyl-ethyl-octylphosphane has a molecular weight of 256.41 g/mol, XLogP of 6.18, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-ethyl-octylphosphane is sourced from PubChem (CID 90109221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).