heptylphosphane

C7H17P — CID 2785193

IUPACheptylphosphane
SMILESCCCCCCCP
InChIInChI=1S/C7H17P/c1-2-3-4-5-6-7-8/h2-8H2,1H3
InChIKeySCCLFGAYCGKMEI-UHFFFAOYSA-N
MW132.19 g/mol
LogP2.83
Rot. Bonds5

About heptylphosphane

heptylphosphane (PubChem CID 2785193) has the molecular formula C7H17P and a molecular weight of 132.19 g/mol. Its IUPAC name is heptylphosphane.

Molecular Properties

Compound Nameheptylphosphane
PubChem CID2785193
Molecular FormulaC7H17P
Molecular Weight132.19 g/mol
Exact Mass132.11
IUPAC Nameheptylphosphane
SMILESCCCCCCCP
InChIInChI=1S/C7H17P/c1-2-3-4-5-6-7-8/h2-8H2,1H3
InChIKeySCCLFGAYCGKMEI-UHFFFAOYSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.19
LogP ≤ 52.83
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 heptylphosphane 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

Phosphine, octyl-
CID 446269
Hexylphosphin
CID 151767
Dodecylphosphine
CID 11367685
n-Nonylphosphin
CID 12524104
n-Tetradecylphosphin
CID 12524105
Decanephosphine
CID 14962376
Tridecylphosphine
CID 18405840
1,2-Diethyl phosphino ethane
CID 21278560
1-Decylphosphonium bromide
CID 21621997
Dodecyl(methyl)phosphane
CID 23418163
Ethyl(heptyl)phosphine
CID 24975693
Decylphosphonium chloride
CID 88466943

Frequently Asked Questions

What is the IUPAC name of heptylphosphane?
The IUPAC name of heptylphosphane (CID 2785193) is heptylphosphane.
What is the SMILES notation for heptylphosphane?
The canonical SMILES for heptylphosphane is CCCCCCCP.
What is the InChIKey of heptylphosphane?
The InChIKey is SCCLFGAYCGKMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17P/c1-2-3-4-5-6-7-8/h2-8H2,1H3.
What are the key properties of heptylphosphane?
heptylphosphane has a molecular weight of 132.19 g/mol, XLogP of 2.83, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for heptylphosphane is sourced from PubChem (CID 2785193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).