[1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane

C11H26O2P2 — CID 57152976

IUPAC[1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane
SMILESCOCC(C)(COC)C(P(C)C)P(C)C
InChIInChI=1S/C11H26O2P2/c1-11(8-12-2,9-13-3)10(14(4)5)15(6)7/h10H,8-9H2,1-7H3
InChIKeyXTXQJEULWNAZRU-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.09
Rot. Bonds7

About [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane

[1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane (PubChem CID 57152976) has the molecular formula C11H26O2P2 and a molecular weight of 252.27 g/mol. Its IUPAC name is [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane.

Molecular Properties

Compound Name[1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane
PubChem CID57152976
Molecular FormulaC11H26O2P2
Molecular Weight252.27 g/mol
Exact Mass252.14
IUPAC Name[1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane
SMILESCOCC(C)(COC)C(P(C)C)P(C)C
InChIInChI=1S/C11H26O2P2/c1-11(8-12-2,9-13-3)10(14(4)5)15(6)7/h10H,8-9H2,1-7H3
InChIKeyXTXQJEULWNAZRU-UHFFFAOYSA-N
XLogP3.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane?
The IUPAC name of [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane (CID 57152976) is [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane.
What is the SMILES notation for [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane?
The canonical SMILES for [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane is COCC(C)(COC)C(P(C)C)P(C)C.
What is the InChIKey of [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane?
The InChIKey is XTXQJEULWNAZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O2P2/c1-11(8-12-2,9-13-3)10(14(4)5)15(6)7/h10H,8-9H2,1-7H3.
What are the key properties of [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane?
[1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane has a molecular weight of 252.27 g/mol, XLogP of 3.09, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-dimethylphosphanyl-3-methoxy-2-(methoxymethyl)-2-methylpropyl]-dimethylphosphane is sourced from PubChem (CID 57152976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).