tetradecylphosphane

C14H31P — CID 12524105

IUPACtetradecylphosphane
SMILESCCCCCCCCCCCCCCP
InChIInChI=1S/C14H31P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3
InChIKeyDAUOXRUBCACRRL-UHFFFAOYSA-N
MW230.38 g/mol
LogP5.56
Rot. Bonds12

About tetradecylphosphane

tetradecylphosphane (PubChem CID 12524105) has the molecular formula C14H31P and a molecular weight of 230.38 g/mol. Its IUPAC name is tetradecylphosphane.

Molecular Properties

Compound Nametetradecylphosphane
PubChem CID12524105
Molecular FormulaC14H31P
Molecular Weight230.38 g/mol
Exact Mass230.22
IUPAC Nametetradecylphosphane
SMILESCCCCCCCCCCCCCCP
InChIInChI=1S/C14H31P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3
InChIKeyDAUOXRUBCACRRL-UHFFFAOYSA-N
XLogP5.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500230.38
LogP ≤ 55.56
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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Frequently Asked Questions

What is the IUPAC name of tetradecylphosphane?
The IUPAC name of tetradecylphosphane (CID 12524105) is tetradecylphosphane.
What is the SMILES notation for tetradecylphosphane?
The canonical SMILES for tetradecylphosphane is CCCCCCCCCCCCCCP.
What is the InChIKey of tetradecylphosphane?
The InChIKey is DAUOXRUBCACRRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-15H2,1H3.
What are the key properties of tetradecylphosphane?
tetradecylphosphane has a molecular weight of 230.38 g/mol, XLogP of 5.56, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetradecylphosphane is sourced from PubChem (CID 12524105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).