2-[ethoxy(methoxy)phosphoryl]prop-1-ene

C6H13O3P — CID 142703298

IUPAC2-[ethoxy(methoxy)phosphoryl]prop-1-ene
SMILESC=C(C)P(=O)(OC)OCC
InChIInChI=1S/C6H13O3P/c1-5-9-10(7,8-4)6(2)3/h2,5H2,1,3-4H3
InChIKeyOFLOLCRWHQMSOW-UHFFFAOYSA-N
MW164.14 g/mol
LogP2.40
Rot. Bonds4

About 2-[ethoxy(methoxy)phosphoryl]prop-1-ene

2-[ethoxy(methoxy)phosphoryl]prop-1-ene (PubChem CID 142703298) has the molecular formula C6H13O3P and a molecular weight of 164.14 g/mol. Its IUPAC name is 2-[ethoxy(methoxy)phosphoryl]prop-1-ene.

Molecular Properties

Compound Name2-[ethoxy(methoxy)phosphoryl]prop-1-ene
PubChem CID142703298
Molecular FormulaC6H13O3P
Molecular Weight164.14 g/mol
Exact Mass164.06
IUPAC Name2-[ethoxy(methoxy)phosphoryl]prop-1-ene
SMILESC=C(C)P(=O)(OC)OCC
InChIInChI=1S/C6H13O3P/c1-5-9-10(7,8-4)6(2)3/h2,5H2,1,3-4H3
InChIKeyOFLOLCRWHQMSOW-UHFFFAOYSA-N
XLogP2.40
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.14
LogP ≤ 52.40
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 2-[ethoxy(methoxy)phosphoryl]prop-1-ene?
The IUPAC name of 2-[ethoxy(methoxy)phosphoryl]prop-1-ene (CID 142703298) is 2-[ethoxy(methoxy)phosphoryl]prop-1-ene.
What is the SMILES notation for 2-[ethoxy(methoxy)phosphoryl]prop-1-ene?
The canonical SMILES for 2-[ethoxy(methoxy)phosphoryl]prop-1-ene is C=C(C)P(=O)(OC)OCC.
What is the InChIKey of 2-[ethoxy(methoxy)phosphoryl]prop-1-ene?
The InChIKey is OFLOLCRWHQMSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13O3P/c1-5-9-10(7,8-4)6(2)3/h2,5H2,1,3-4H3.
What are the key properties of 2-[ethoxy(methoxy)phosphoryl]prop-1-ene?
2-[ethoxy(methoxy)phosphoryl]prop-1-ene has a molecular weight of 164.14 g/mol, XLogP of 2.40, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethoxy(methoxy)phosphoryl]prop-1-ene is sourced from PubChem (CID 142703298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).