dodecyl(dimethyl)phosphanium chloride

C14H32ClP — CID 159854055

IUPACdodecyl(dimethyl)phosphanium chloride
SMILESCCCCCCCCCCCC[PH+](C)C.[Cl-]
InChIInChI=1S/C14H31P.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3;/h4-14H2,1-3H3;1H
InChIKeyNQHLZJSNZNFANF-UHFFFAOYSA-N
MW266.84 g/mol
LogP2.39
Rot. Bonds11

About dodecyl(dimethyl)phosphanium chloride

dodecyl(dimethyl)phosphanium chloride (PubChem CID 159854055) has the molecular formula C14H32ClP and a molecular weight of 266.84 g/mol. Its IUPAC name is dodecyl(dimethyl)phosphanium chloride.

Molecular Properties

Compound Namedodecyl(dimethyl)phosphanium chloride
PubChem CID159854055
Molecular FormulaC14H32ClP
Molecular Weight266.84 g/mol
Exact Mass266.19
IUPAC Namedodecyl(dimethyl)phosphanium chloride
SMILESCCCCCCCCCCCC[PH+](C)C.[Cl-]
InChIInChI=1S/C14H31P.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3;/h4-14H2,1-3H3;1H
InChIKeyNQHLZJSNZNFANF-UHFFFAOYSA-N
XLogP2.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.84
LogP ≤ 52.39
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 dodecyl(dimethyl)phosphanium chloride 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

dioxido-oxo-propyl-λ5-phosphane;bis(dodecyl(dimethyl)phosphanium)
CID 158898969
undecane chloride
CID 19736895
magnesium;undecane;dichloride
CID 175829094
azanium;dodecane;chloride
CID 172693740
azanium;octacosane;chloride
CID 172810874
palladium;bis(trioctylphosphanium)
CID 88742312
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
decane;heptane
CID 159049036
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
dohexacontane
CID 522644

Frequently Asked Questions

What is the IUPAC name of dodecyl(dimethyl)phosphanium chloride?
The IUPAC name of dodecyl(dimethyl)phosphanium chloride (CID 159854055) is dodecyl(dimethyl)phosphanium chloride.
What is the SMILES notation for dodecyl(dimethyl)phosphanium chloride?
The canonical SMILES for dodecyl(dimethyl)phosphanium chloride is CCCCCCCCCCCC[PH+](C)C.[Cl-].
What is the InChIKey of dodecyl(dimethyl)phosphanium chloride?
The InChIKey is NQHLZJSNZNFANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31P.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3;/h4-14H2,1-3H3;1H.
What are the key properties of dodecyl(dimethyl)phosphanium chloride?
dodecyl(dimethyl)phosphanium chloride has a molecular weight of 266.84 g/mol, XLogP of 2.39, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dodecyl(dimethyl)phosphanium chloride is sourced from PubChem (CID 159854055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).