[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene

C15H17O3P — CID 10978723

IUPAC[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene
SMILESCP(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C15H17O3P/c1-19(16,17-12-14-8-4-2-5-9-14)18-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKeyBPYBCKBGKAIOBH-UHFFFAOYSA-N
MW276.27 g/mol
LogP4.24
Rot. Bonds6

About [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene

[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene (PubChem CID 10978723) has the molecular formula C15H17O3P and a molecular weight of 276.27 g/mol. Its IUPAC name is [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene.

Molecular Properties

Compound Name[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene
PubChem CID10978723
Molecular FormulaC15H17O3P
Molecular Weight276.27 g/mol
Exact Mass276.09
IUPAC Name[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene
SMILESCP(=O)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C15H17O3P/c1-19(16,17-12-14-8-4-2-5-9-14)18-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKeyBPYBCKBGKAIOBH-UHFFFAOYSA-N
XLogP4.24
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.27
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene?
The IUPAC name of [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene (CID 10978723) is [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene.
What is the SMILES notation for [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene?
The canonical SMILES for [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene is CP(=O)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene?
The InChIKey is BPYBCKBGKAIOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17O3P/c1-19(16,17-12-14-8-4-2-5-9-14)18-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3.
What are the key properties of [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene?
[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene has a molecular weight of 276.27 g/mol, XLogP of 4.24, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl(phenylmethoxy)phosphoryl]oxymethylbenzene is sourced from PubChem (CID 10978723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).