hexadecyl(propyl)phosphane

C19H41P — CID 158670728

IUPAChexadecyl(propyl)phosphane
SMILESCCCCCCCCCCCCCCCCPCCC
InChIInChI=1S/C19H41P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20-18-4-2/h20H,3-19H2,1-2H3
InChIKeyVOLOFTWNWYUJAS-UHFFFAOYSA-N
MW300.51 g/mol
LogP7.56
Rot. Bonds17

About hexadecyl(propyl)phosphane

hexadecyl(propyl)phosphane (PubChem CID 158670728) has the molecular formula C19H41P and a molecular weight of 300.51 g/mol. Its IUPAC name is hexadecyl(propyl)phosphane.

Molecular Properties

Compound Namehexadecyl(propyl)phosphane
PubChem CID158670728
Molecular FormulaC19H41P
Molecular Weight300.51 g/mol
Exact Mass300.29
IUPAC Namehexadecyl(propyl)phosphane
SMILESCCCCCCCCCCCCCCCCPCCC
InChIInChI=1S/C19H41P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20-18-4-2/h20H,3-19H2,1-2H3
InChIKeyVOLOFTWNWYUJAS-UHFFFAOYSA-N
XLogP7.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.51
LogP ≤ 57.56
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

decyl(undecyl)phosphane
CID 87830755
di(nonadecyl)phosphane
CID 87828565
dodecyl(octyl)phosphane
CID 87829037
di(nonyl)phosphane;hydrochloride
CID 175813490
butyl(heptadecyl)phosphane
CID 146521828
dipentylphosphane
CID 11105867
butyl(propyl)phosphane;methane
CID 158586194
dipropylphosphane
CID 12057559
docosyl(docosylphosphanyl)phosphane
CID 21095052
octyl(pentylphosphanyl)phosphane
CID 21095189
sodium;dipropylphosphane;hydride
CID 175309333
sodium;butanedioic acid;dioctylphosphane;hydride
CID 175055356

Frequently Asked Questions

What is the IUPAC name of hexadecyl(propyl)phosphane?
The IUPAC name of hexadecyl(propyl)phosphane (CID 158670728) is hexadecyl(propyl)phosphane.
What is the SMILES notation for hexadecyl(propyl)phosphane?
The canonical SMILES for hexadecyl(propyl)phosphane is CCCCCCCCCCCCCCCCPCCC.
What is the InChIKey of hexadecyl(propyl)phosphane?
The InChIKey is VOLOFTWNWYUJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20-18-4-2/h20H,3-19H2,1-2H3.
What are the key properties of hexadecyl(propyl)phosphane?
hexadecyl(propyl)phosphane has a molecular weight of 300.51 g/mol, XLogP of 7.56, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexadecyl(propyl)phosphane is sourced from PubChem (CID 158670728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).