hexadecylphosphane

C16H35P — CID 14366173

IUPAChexadecylphosphane
SMILESCCCCCCCCCCCCCCCCP
InChIInChI=1S/C16H35P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-17H2,1H3
InChIKeyQSOFCURVDKCVCM-UHFFFAOYSA-N
MW258.43 g/mol
LogP6.34
Rot. Bonds14

About hexadecylphosphane

hexadecylphosphane (PubChem CID 14366173) has the molecular formula C16H35P and a molecular weight of 258.43 g/mol. Its IUPAC name is hexadecylphosphane.

Molecular Properties

Compound Namehexadecylphosphane
PubChem CID14366173
Molecular FormulaC16H35P
Molecular Weight258.43 g/mol
Exact Mass258.25
IUPAC Namehexadecylphosphane
SMILESCCCCCCCCCCCCCCCCP
InChIInChI=1S/C16H35P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-17H2,1H3
InChIKeyQSOFCURVDKCVCM-UHFFFAOYSA-N
XLogP6.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.43
LogP ≤ 56.34
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

Tri-n-butyl tetradecyl phosphonium chloride
CID 9889168
Hexadecyltributylphosphonium bromide
CID 84716
Trioctylphosphine
CID 20851
Phosphine, tridodecyl-
CID 80863
Phosphine sulfide, trioctyl-
CID 75697
Stearyltributylphosphonium bromide
CID 22169156
Tetradecyltrimethylphosphonium
CID 3036617
Octadecyltrimethylphosphonium chloride
CID 20031278
Didecyldimethylphosphonium chloride
CID 20351238
Ditetradecyldimethylphosphonium chloride
CID 21249616
Tributyltetradecylphosphonium
CID 183729
Tri-n-octyl phosphine selenide
CID 12163534

Frequently Asked Questions

What is the IUPAC name of hexadecylphosphane?
The IUPAC name of hexadecylphosphane (CID 14366173) is hexadecylphosphane.
What is the SMILES notation for hexadecylphosphane?
The canonical SMILES for hexadecylphosphane is CCCCCCCCCCCCCCCCP.
What is the InChIKey of hexadecylphosphane?
The InChIKey is QSOFCURVDKCVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-17H2,1H3.
What are the key properties of hexadecylphosphane?
hexadecylphosphane has a molecular weight of 258.43 g/mol, XLogP of 6.34, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexadecylphosphane is sourced from PubChem (CID 14366173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).