[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene

C16H19O3P — CID 4116161

IUPAC[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene
SMILESCOCCOCP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19O3P/c1-18-12-13-19-14-20(17,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11H,12-14H2,1H3
InChIKeyHPTXJSUXUZDGBH-UHFFFAOYSA-N
MW290.30 g/mol
LogP2.62
Rot. Bonds7

About [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene

[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene (PubChem CID 4116161) has the molecular formula C16H19O3P and a molecular weight of 290.30 g/mol. Its IUPAC name is [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene.

Molecular Properties

Compound Name[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene
PubChem CID4116161
Molecular FormulaC16H19O3P
Molecular Weight290.30 g/mol
Exact Mass290.11
IUPAC Name[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene
SMILESCOCCOCP(=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19O3P/c1-18-12-13-19-14-20(17,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11H,12-14H2,1H3
InChIKeyHPTXJSUXUZDGBH-UHFFFAOYSA-N
XLogP2.62
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.30
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[6-methoxyhexyl(phenyl)phosphoryl]benzene
CID 141463056
2-[methoxymethyl(phenyl)phosphoryl]naphthalene
CID 100982565
[2-ethoxyethyl(phenyl)phosphoryl]benzene
CID 2304634
benzene;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 19879698
2-diphenylphosphorylethyl(ethoxy)phosphinic acid
CID 102209255
[2-dimethoxyphosphorylethyl(phenyl)phosphoryl]benzene
CID 15362204
[diphenylphosphorylmethyl(phenyl)phosphoryl]benzene;terbium(3+)
CID 170659309
3-(2-methoxyethoxy)-2-phenylpropanoic acid
CID 63073447
2-[2-(2-methoxyethoxy)ethoxy]ethoxymethylbenzene
CID 15050635
2-(2-methoxyethoxy)ethylbenzene
CID 21135488
dipropoxyphosphorylbenzene
CID 11736632
2-methoxyethoxymethylidene(triphenyl)-lambda5-phosphane
CID 15581400

Frequently Asked Questions

What is the IUPAC name of [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene?
The IUPAC name of [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene (CID 4116161) is [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene.
What is the SMILES notation for [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene?
The canonical SMILES for [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene is COCCOCP(=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene?
The InChIKey is HPTXJSUXUZDGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19O3P/c1-18-12-13-19-14-20(17,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11H,12-14H2,1H3.
What are the key properties of [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene?
[2-methoxyethoxymethyl(phenyl)phosphoryl]benzene has a molecular weight of 290.30 g/mol, XLogP of 2.62, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxyethoxymethyl(phenyl)phosphoryl]benzene is sourced from PubChem (CID 4116161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).