butyl(cyclohexyl)phosphane

C10H21P — CID 69424025

IUPACbutyl(cyclohexyl)phosphane
SMILESCCCCPC1CCCCC1
InChIInChI=1S/C10H21P/c1-2-3-9-11-10-7-5-4-6-8-10/h10-11H,2-9H2,1H3
InChIKeyNSLWCWMENMVGEW-UHFFFAOYSA-N
MW172.25 g/mol
LogP3.80
Rot. Bonds4

About butyl(cyclohexyl)phosphane

butyl(cyclohexyl)phosphane (PubChem CID 69424025) has the molecular formula C10H21P and a molecular weight of 172.25 g/mol. Its IUPAC name is butyl(cyclohexyl)phosphane.

Molecular Properties

Compound Namebutyl(cyclohexyl)phosphane
PubChem CID69424025
Molecular FormulaC10H21P
Molecular Weight172.25 g/mol
Exact Mass172.14
IUPAC Namebutyl(cyclohexyl)phosphane
SMILESCCCCPC1CCCCC1
InChIInChI=1S/C10H21P/c1-2-3-9-11-10-7-5-4-6-8-10/h10-11H,2-9H2,1H3
InChIKeyNSLWCWMENMVGEW-UHFFFAOYSA-N
XLogP3.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 53.80
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'}

Analyze butyl(cyclohexyl)phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclohexyl(dodecyl)phosphane
CID 69424863
cycloheptyl(hexyl)phosphane
CID 69424850
cyclooctyl(nonyl)phosphane
CID 69422737
cyclohexyl(decyl)phosphane
CID 69427092
cyclopentyl(pentyl)phosphane;hydrochloride
CID 174737364
cyclopentyl(decyl)phosphane
CID 69425127
cyclobutyl(pentyl)phosphane;hydrochloride
CID 174737405
cyclopropyl(nonyl)phosphane
CID 69425063
cyclohexyl(pentylphosphanylmethyl)phosphane
CID 146513852
cyclopropyl(hexyl)phosphane;hydrochloride
CID 174737397
butyl-(3,3-dipropylcyclohexyl)phosphane
CID 173289478
but-3-ynyl(cyclohexyl)phosphane
CID 101427052

Frequently Asked Questions

What is the IUPAC name of butyl(cyclohexyl)phosphane?
The IUPAC name of butyl(cyclohexyl)phosphane (CID 69424025) is butyl(cyclohexyl)phosphane.
What is the SMILES notation for butyl(cyclohexyl)phosphane?
The canonical SMILES for butyl(cyclohexyl)phosphane is CCCCPC1CCCCC1.
What is the InChIKey of butyl(cyclohexyl)phosphane?
The InChIKey is NSLWCWMENMVGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21P/c1-2-3-9-11-10-7-5-4-6-8-10/h10-11H,2-9H2,1H3.
What are the key properties of butyl(cyclohexyl)phosphane?
butyl(cyclohexyl)phosphane has a molecular weight of 172.25 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl(cyclohexyl)phosphane is sourced from PubChem (CID 69424025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).