CID 158135492

C12H27KP — CID 158135492

IUPAC—
SMILESCCCCCCCCCCCCP.[K]
InChIInChI=1S/C12H27P.K/c1-2-3-4-5-6-7-8-9-10-11-12-13;/h2-13H2,1H3;
InChIKeyLBRVPIARUHNULI-UHFFFAOYSA-N
MW241.42 g/mol
LogP4.40
Rot. Bonds10

About CID 158135492

CID 158135492 (PubChem CID 158135492) has the molecular formula C12H27KP and a molecular weight of 241.42 g/mol.

Molecular Properties

Compound NameCID 158135492
PubChem CID158135492
Molecular FormulaC12H27KP
Molecular Weight241.42 g/mol
Exact Mass241.15
IUPAC Name—
SMILESCCCCCCCCCCCCP.[K]
InChIInChI=1S/C12H27P.K/c1-2-3-4-5-6-7-8-9-10-11-12-13;/h2-13H2,1H3;
InChIKeyLBRVPIARUHNULI-UHFFFAOYSA-N
XLogP4.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 54.40
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 CID 158135492 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

tetradecylphosphane;hydrochloride
CID 173055472
ruthenium;tridecylphosphane
CID 159569065
nonylphosphane;hydrobromide
CID 173198265
decylphosphane;hydrate
CID 175258156
octylphosphane;tetramethylphosphanium;bromide
CID 174836712
N,N-dimethylmethanamine;octadecylphosphane;hydrate
CID 174723462
heptan-1-ol;heptylphosphane
CID 88830692
butylphosphane;tellane
CID 175275309
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
dohexacontane
CID 522644
hexacosane;octacosane
CID 158944700

Frequently Asked Questions

What is the IUPAC name of CID 158135492?
The IUPAC name of CID 158135492 (CID 158135492) is not available.
What is the SMILES notation for CID 158135492?
The canonical SMILES for CID 158135492 is CCCCCCCCCCCCP.[K].
What is the InChIKey of CID 158135492?
The InChIKey is LBRVPIARUHNULI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27P.K/c1-2-3-4-5-6-7-8-9-10-11-12-13;/h2-13H2,1H3;.
What are the key properties of CID 158135492?
CID 158135492 has a molecular weight of 241.42 g/mol, XLogP of 4.40, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158135492 is sourced from PubChem (CID 158135492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).