methoxymethyl(triphenyl)phosphanium

C20H20OP+ — CID 2723799

IUPACmethoxymethyl(triphenyl)phosphanium
SMILESCOC[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20OP/c1-21-17-22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,17H2,1H3/q+1
InChIKeySDMCZCALYDCRBH-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.58
Rot. Bonds5

About methoxymethyl(triphenyl)phosphanium

methoxymethyl(triphenyl)phosphanium (PubChem CID 2723799) has the molecular formula C20H20OP+ and a molecular weight of 307.35 g/mol. Its IUPAC name is methoxymethyl(triphenyl)phosphanium.

Molecular Properties

Compound Namemethoxymethyl(triphenyl)phosphanium
PubChem CID2723799
Molecular FormulaC20H20OP+
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Namemethoxymethyl(triphenyl)phosphanium
SMILESCOC[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20OP/c1-21-17-22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,17H2,1H3/q+1
InChIKeySDMCZCALYDCRBH-UHFFFAOYSA-N
XLogP3.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxymethyl(triphenyl)phosphanium?
The IUPAC name of methoxymethyl(triphenyl)phosphanium (CID 2723799) is methoxymethyl(triphenyl)phosphanium.
What is the SMILES notation for methoxymethyl(triphenyl)phosphanium?
The canonical SMILES for methoxymethyl(triphenyl)phosphanium is COC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of methoxymethyl(triphenyl)phosphanium?
The InChIKey is SDMCZCALYDCRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20OP/c1-21-17-22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,17H2,1H3/q+1.
What are the key properties of methoxymethyl(triphenyl)phosphanium?
methoxymethyl(triphenyl)phosphanium has a molecular weight of 307.35 g/mol, XLogP of 3.58, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethyl(triphenyl)phosphanium is sourced from PubChem (CID 2723799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).