benzyl-methyl-dipropylphosphanium

C14H24P+ — CID 23546516

IUPACbenzyl-methyl-dipropylphosphanium
SMILESCCC[P+](C)(CCC)Cc1ccccc1
InChIInChI=1S/C14H24P/c1-4-11-15(3,12-5-2)13-14-9-7-6-8-10-14/h6-10H,4-5,11-13H2,1-3H3/q+1
InChIKeyGJUXFGVLTFLRTQ-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.65
Rot. Bonds6

About benzyl-methyl-dipropylphosphanium

benzyl-methyl-dipropylphosphanium (PubChem CID 23546516) has the molecular formula C14H24P+ and a molecular weight of 223.32 g/mol. Its IUPAC name is benzyl-methyl-dipropylphosphanium.

Molecular Properties

Compound Namebenzyl-methyl-dipropylphosphanium
PubChem CID23546516
Molecular FormulaC14H24P+
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Namebenzyl-methyl-dipropylphosphanium
SMILESCCC[P+](C)(CCC)Cc1ccccc1
InChIInChI=1S/C14H24P/c1-4-11-15(3,12-5-2)13-14-9-7-6-8-10-14/h6-10H,4-5,11-13H2,1-3H3/q+1
InChIKeyGJUXFGVLTFLRTQ-UHFFFAOYSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

benzyl(tripropyl)phosphanium bromide
CID 68744786
benzyl-dimethyl-pentadecylphosphanium
CID 157445205
benzyl-decyl-dimethylphosphanium chloride
CID 67153395
benzyl-dimethyl-tetradecylphosphanium bromide
CID 69306168
benzyl(trimethyl)phosphanium;hydrobromide
CID 154945301
benzyl(trimethyl)phosphanium;hydrochloride
CID 154945285
dibenzyl-hexyl-propylphosphanium
CID 175204053
tribenzyl(ethyl)phosphanium
CID 23415376
dibenzyl(didecyl)phosphanium
CID 69307785
dibenzyl(dipentyl)phosphanium chloride
CID 69306220
(3-bromo-2-methylhexyl)benzene
CID 83051885
tribenzyl(decyl)phosphanium iodide
CID 69307604

Frequently Asked Questions

What is the IUPAC name of benzyl-methyl-dipropylphosphanium?
The IUPAC name of benzyl-methyl-dipropylphosphanium (CID 23546516) is benzyl-methyl-dipropylphosphanium.
What is the SMILES notation for benzyl-methyl-dipropylphosphanium?
The canonical SMILES for benzyl-methyl-dipropylphosphanium is CCC[P+](C)(CCC)Cc1ccccc1.
What is the InChIKey of benzyl-methyl-dipropylphosphanium?
The InChIKey is GJUXFGVLTFLRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24P/c1-4-11-15(3,12-5-2)13-14-9-7-6-8-10-14/h6-10H,4-5,11-13H2,1-3H3/q+1.
What are the key properties of benzyl-methyl-dipropylphosphanium?
benzyl-methyl-dipropylphosphanium has a molecular weight of 223.32 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-methyl-dipropylphosphanium is sourced from PubChem (CID 23546516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).