bis(benzylperoxy)-oxophosphanium

C14H14O5P+ — CID 22644121

IUPACbis(benzylperoxy)-oxophosphanium
SMILESO=[P+](OOCc1ccccc1)OOCc1ccccc1
InChIInChI=1S/C14H14O5P/c15-20(18-16-11-13-7-3-1-4-8-13)19-17-12-14-9-5-2-6-10-14/h1-10H,11-12H2/q+1
InChIKeyDWMMHJBRYDJTHN-UHFFFAOYSA-N
MW293.24 g/mol
LogP3.94
Rot. Bonds8

About bis(benzylperoxy)-oxophosphanium

bis(benzylperoxy)-oxophosphanium (PubChem CID 22644121) has the molecular formula C14H14O5P+ and a molecular weight of 293.24 g/mol. Its IUPAC name is bis(benzylperoxy)-oxophosphanium.

Molecular Properties

Compound Namebis(benzylperoxy)-oxophosphanium
PubChem CID22644121
Molecular FormulaC14H14O5P+
Molecular Weight293.24 g/mol
Exact Mass293.06
IUPAC Namebis(benzylperoxy)-oxophosphanium
SMILESO=[P+](OOCc1ccccc1)OOCc1ccccc1
InChIInChI=1S/C14H14O5P/c15-20(18-16-11-13-7-3-1-4-8-13)19-17-12-14-9-5-2-6-10-14/h1-10H,11-12H2/q+1
InChIKeyDWMMHJBRYDJTHN-UHFFFAOYSA-N
XLogP3.94
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.24
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

dihydroxy(oxo)phosphanium;oxo-bis(phenylmethoxy)phosphanium
CID 159366011
chloro-oxo-phenylmethoxyphosphanium
CID 23320599
oxo-bis(phenylmethoxymethoxy)phosphanium
CID 68931387
methyl-oxo-phenylmethoxyphosphanium
CID 20566646
oxo-(2-phenylethoxy)-phenylmethoxyphosphanium
CID 70073621
disodium bis(oxido-oxo-phenylmethoxyphosphanium)
CID 171808155
bis(phenylmethoxy)phosphorylmethyl-oxo-phenylmethoxyphosphanium
CID 155609893
CID 66734377
CID 66734377
1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
CID 68630458
CID 68630458
phenylmethoxy-λ2-plumbane
CID 173082625
phenylmethoxygallane
CID 173378988

Frequently Asked Questions

What is the IUPAC name of bis(benzylperoxy)-oxophosphanium?
The IUPAC name of bis(benzylperoxy)-oxophosphanium (CID 22644121) is bis(benzylperoxy)-oxophosphanium.
What is the SMILES notation for bis(benzylperoxy)-oxophosphanium?
The canonical SMILES for bis(benzylperoxy)-oxophosphanium is O=[P+](OOCc1ccccc1)OOCc1ccccc1.
What is the InChIKey of bis(benzylperoxy)-oxophosphanium?
The InChIKey is DWMMHJBRYDJTHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O5P/c15-20(18-16-11-13-7-3-1-4-8-13)19-17-12-14-9-5-2-6-10-14/h1-10H,11-12H2/q+1.
What are the key properties of bis(benzylperoxy)-oxophosphanium?
bis(benzylperoxy)-oxophosphanium has a molecular weight of 293.24 g/mol, XLogP of 3.94, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(benzylperoxy)-oxophosphanium is sourced from PubChem (CID 22644121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).