(1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane

C6H16O3P2 — CID 18720386

IUPAC(1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane
SMILESCOCC(COPC)OPC
InChIInChI=1S/C6H16O3P2/c1-7-4-6(9-11-3)5-8-10-2/h6,10-11H,4-5H2,1-3H3
InChIKeyWHAAGPSJYHIIKL-UHFFFAOYSA-N
MW198.14 g/mol
LogP1.48
Rot. Bonds7

About (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane

(1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane (PubChem CID 18720386) has the molecular formula C6H16O3P2 and a molecular weight of 198.14 g/mol. Its IUPAC name is (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane.

Molecular Properties

Compound Name(1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane
PubChem CID18720386
Molecular FormulaC6H16O3P2
Molecular Weight198.14 g/mol
Exact Mass198.06
IUPAC Name(1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane
SMILESCOCC(COPC)OPC
InChIInChI=1S/C6H16O3P2/c1-7-4-6(9-11-3)5-8-10-2/h6,10-11H,4-5H2,1-3H3
InChIKeyWHAAGPSJYHIIKL-UHFFFAOYSA-N
XLogP1.48
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.14
LogP ≤ 51.48
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 (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane?
The IUPAC name of (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane (CID 18720386) is (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane.
What is the SMILES notation for (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane?
The canonical SMILES for (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane is COCC(COPC)OPC.
What is the InChIKey of (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane?
The InChIKey is WHAAGPSJYHIIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16O3P2/c1-7-4-6(9-11-3)5-8-10-2/h6,10-11H,4-5H2,1-3H3.
What are the key properties of (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane?
(1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane has a molecular weight of 198.14 g/mol, XLogP of 1.48, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-3-methylphosphanyloxypropan-2-yl)oxy-methylphosphane is sourced from PubChem (CID 18720386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).