anisole;[methoxy(methyl)phosphoryl]oxymethane

C17H25O5P — CID 175280701

IUPACanisole;[methoxy(methyl)phosphoryl]oxymethane
SMILESCOP(C)(=O)OC.COc1ccccc1.COc1ccccc1
InChIInChI=1S/2C7H8O.C3H9O3P/c2*1-8-7-5-3-2-4-6-7;1-5-7(3,4)6-2/h2*2-6H,1H3;1-3H3
InChIKeyWKVXWBSDOPRTMD-UHFFFAOYSA-N
MW340.36 g/mol
LogP4.49
Rot. Bonds4

About anisole;[methoxy(methyl)phosphoryl]oxymethane

anisole;[methoxy(methyl)phosphoryl]oxymethane (PubChem CID 175280701) has the molecular formula C17H25O5P and a molecular weight of 340.36 g/mol. Its IUPAC name is anisole;[methoxy(methyl)phosphoryl]oxymethane.

Molecular Properties

Compound Nameanisole;[methoxy(methyl)phosphoryl]oxymethane
PubChem CID175280701
Molecular FormulaC17H25O5P
Molecular Weight340.36 g/mol
Exact Mass340.14
IUPAC Nameanisole;[methoxy(methyl)phosphoryl]oxymethane
SMILESCOP(C)(=O)OC.COc1ccccc1.COc1ccccc1
InChIInChI=1S/2C7H8O.C3H9O3P/c2*1-8-7-5-3-2-4-6-7;1-5-7(3,4)6-2/h2*2-6H,1H3;1-3H3
InChIKeyWKVXWBSDOPRTMD-UHFFFAOYSA-N
XLogP4.49
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.36
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of anisole;[methoxy(methyl)phosphoryl]oxymethane?
The IUPAC name of anisole;[methoxy(methyl)phosphoryl]oxymethane (CID 175280701) is anisole;[methoxy(methyl)phosphoryl]oxymethane.
What is the SMILES notation for anisole;[methoxy(methyl)phosphoryl]oxymethane?
The canonical SMILES for anisole;[methoxy(methyl)phosphoryl]oxymethane is COP(C)(=O)OC.COc1ccccc1.COc1ccccc1.
What is the InChIKey of anisole;[methoxy(methyl)phosphoryl]oxymethane?
The InChIKey is WKVXWBSDOPRTMD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H8O.C3H9O3P/c2*1-8-7-5-3-2-4-6-7;1-5-7(3,4)6-2/h2*2-6H,1H3;1-3H3.
What are the key properties of anisole;[methoxy(methyl)phosphoryl]oxymethane?
anisole;[methoxy(methyl)phosphoryl]oxymethane has a molecular weight of 340.36 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for anisole;[methoxy(methyl)phosphoryl]oxymethane is sourced from PubChem (CID 175280701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).