dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane

C7H15O3P — CID 123453217

IUPACdimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane
SMILESC=C(CP(=C)(OC)OC)OC
InChIInChI=1S/C7H15O3P/c1-7(8-2)6-11(5,9-3)10-4/h1,5-6H2,2-4H3
InChIKeyYDESKDVWDIRLQM-UHFFFAOYSA-N
MW178.17 g/mol
LogP1.72
Rot. Bonds5

About dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane

dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane (PubChem CID 123453217) has the molecular formula C7H15O3P and a molecular weight of 178.17 g/mol. Its IUPAC name is dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane.

Molecular Properties

Compound Namedimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane
PubChem CID123453217
Molecular FormulaC7H15O3P
Molecular Weight178.17 g/mol
Exact Mass178.08
IUPAC Namedimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane
SMILESC=C(CP(=C)(OC)OC)OC
InChIInChI=1S/C7H15O3P/c1-7(8-2)6-11(5,9-3)10-4/h1,5-6H2,2-4H3
InChIKeyYDESKDVWDIRLQM-UHFFFAOYSA-N
XLogP1.72
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.17
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane?
The IUPAC name of dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane (CID 123453217) is dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane.
What is the SMILES notation for dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane?
The canonical SMILES for dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane is C=C(CP(=C)(OC)OC)OC.
What is the InChIKey of dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane?
The InChIKey is YDESKDVWDIRLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15O3P/c1-7(8-2)6-11(5,9-3)10-4/h1,5-6H2,2-4H3.
What are the key properties of dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane?
dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane has a molecular weight of 178.17 g/mol, XLogP of 1.72, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-(2-methoxyprop-2-enyl)-methylidene-λ5-phosphane is sourced from PubChem (CID 123453217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).