dibutyl(tetradecyl)phosphane

C22H47P — CID 118319275

IUPACdibutyl(tetradecyl)phosphane
SMILESCCCCCCCCCCCCCCP(CCCC)CCCC
InChIInChI=1S/C22H47P/c1-4-7-10-11-12-13-14-15-16-17-18-19-22-23(20-8-5-2)21-9-6-3/h4-22H2,1-3H3
InChIKeyMRNXLMVJKUIMCS-UHFFFAOYSA-N
MW342.59 g/mol
LogP8.77
Rot. Bonds19

About dibutyl(tetradecyl)phosphane

dibutyl(tetradecyl)phosphane (PubChem CID 118319275) has the molecular formula C22H47P and a molecular weight of 342.59 g/mol. Its IUPAC name is dibutyl(tetradecyl)phosphane.

Molecular Properties

Compound Namedibutyl(tetradecyl)phosphane
PubChem CID118319275
Molecular FormulaC22H47P
Molecular Weight342.59 g/mol
Exact Mass342.34
IUPAC Namedibutyl(tetradecyl)phosphane
SMILESCCCCCCCCCCCCCCP(CCCC)CCCC
InChIInChI=1S/C22H47P/c1-4-7-10-11-12-13-14-15-16-17-18-19-22-23(20-8-5-2)21-9-6-3/h4-22H2,1-3H3
InChIKeyMRNXLMVJKUIMCS-UHFFFAOYSA-N
XLogP8.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds19
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.59
LogP ≤ 58.77
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

dibutyl(decyl)phosphane
CID 171559269
4-dihexylphosphanylbutyl(dihexyl)phosphane
CID 90109945
dibutyl(5-dibutylphosphanylpentyl)phosphane
CID 90109453
hexyl-octyl-pentylphosphane
CID 90108526
dodecane;trioctylphosphane;dihydrobromide
CID 173344161
bismuthane;trioctylphosphane
CID 174398286
2-dioctadecylphosphanylethyl(dioctadecyl)phosphane
CID 21448799
2-diheptylphosphanylethyl(diheptyl)phosphane
CID 90110075
tris(trioctylphosphane);tungsten
CID 158972203
tripentylphosphane
CID 2784073
cadmium;selane;trioctylphosphane
CID 174961482
butyl-pentyl-propylphosphane
CID 171559250

Frequently Asked Questions

What is the IUPAC name of dibutyl(tetradecyl)phosphane?
The IUPAC name of dibutyl(tetradecyl)phosphane (CID 118319275) is dibutyl(tetradecyl)phosphane.
What is the SMILES notation for dibutyl(tetradecyl)phosphane?
The canonical SMILES for dibutyl(tetradecyl)phosphane is CCCCCCCCCCCCCCP(CCCC)CCCC.
What is the InChIKey of dibutyl(tetradecyl)phosphane?
The InChIKey is MRNXLMVJKUIMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H47P/c1-4-7-10-11-12-13-14-15-16-17-18-19-22-23(20-8-5-2)21-9-6-3/h4-22H2,1-3H3.
What are the key properties of dibutyl(tetradecyl)phosphane?
dibutyl(tetradecyl)phosphane has a molecular weight of 342.59 g/mol, XLogP of 8.77, 19 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl(tetradecyl)phosphane is sourced from PubChem (CID 118319275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).