1-[ethoxy(methoxymethyl)phosphoryl]oxyethane

C6H15O4P — CID 11658394

IUPAC1-[ethoxy(methoxymethyl)phosphoryl]oxyethane
SMILESCCOP(=O)(COC)OCC
InChIInChI=1S/C6H15O4P/c1-4-9-11(7,6-8-3)10-5-2/h4-6H2,1-3H3
InChIKeyIWEOGHGFCXMKFM-UHFFFAOYSA-N
MW182.16 g/mol
LogP1.86
Rot. Bonds6

About 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane

1-[ethoxy(methoxymethyl)phosphoryl]oxyethane (PubChem CID 11658394) has the molecular formula C6H15O4P and a molecular weight of 182.16 g/mol. Its IUPAC name is 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane.

Molecular Properties

Compound Name1-[ethoxy(methoxymethyl)phosphoryl]oxyethane
PubChem CID11658394
Molecular FormulaC6H15O4P
Molecular Weight182.16 g/mol
Exact Mass182.07
IUPAC Name1-[ethoxy(methoxymethyl)phosphoryl]oxyethane
SMILESCCOP(=O)(COC)OCC
InChIInChI=1S/C6H15O4P/c1-4-9-11(7,6-8-3)10-5-2/h4-6H2,1-3H3
InChIKeyIWEOGHGFCXMKFM-UHFFFAOYSA-N
XLogP1.86
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.16
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diethoxyphosphorylmethyl propanoate
CID 12709685
sodium diethoxyphosphorylmethanol
CID 22274944
1-[chloromethoxymethyl(ethoxy)phosphoryl]oxyethane
CID 14258001
1-[fluoromethyl(methoxy)phosphoryl]oxyethane
CID 13426238
3-[ethoxy(methoxy)phosphoryl]-2-methylprop-1-ene
CID 142703300
1,5-bis(diethoxyphosphoryl)pentan-3-one
CID 12030147
diethoxyphosphorylmethyl prop-2-enyl carbonate
CID 23420194
(Z)-1-diethoxyphosphoryl-N-methoxypropan-2-imine
CID 129409647
1-[ethoxy(methoxy)phosphoryl]butane
CID 86081258
ethyl 2-diethoxyphosphorylacetate
CID 10911236
diethyl 2-methoxyethyl phosphate
CID 547489
[ethoxy(ethyl)phosphoryl] hypochlorite
CID 87057693

Frequently Asked Questions

What is the IUPAC name of 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane?
The IUPAC name of 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane (CID 11658394) is 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane.
What is the SMILES notation for 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane?
The canonical SMILES for 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane is CCOP(=O)(COC)OCC.
What is the InChIKey of 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane?
The InChIKey is IWEOGHGFCXMKFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15O4P/c1-4-9-11(7,6-8-3)10-5-2/h4-6H2,1-3H3.
What are the key properties of 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane?
1-[ethoxy(methoxymethyl)phosphoryl]oxyethane has a molecular weight of 182.16 g/mol, XLogP of 1.86, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethoxy(methoxymethyl)phosphoryl]oxyethane is sourced from PubChem (CID 11658394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).