2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane

C9H21O3P — CID 59893550

IUPAC2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane
SMILESCOC(C)(C)P(=O)(OC)C(C)(C)C
InChIInChI=1S/C9H21O3P/c1-8(2,3)13(10,12-7)9(4,5)11-6/h1-7H3
InChIKeyMCPXFEYWHCOYDJ-UHFFFAOYSA-N
MW208.24 g/mol
LogP3.09
Rot. Bonds3

About 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane

2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane (PubChem CID 59893550) has the molecular formula C9H21O3P and a molecular weight of 208.24 g/mol. Its IUPAC name is 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane.

Molecular Properties

Compound Name2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane
PubChem CID59893550
Molecular FormulaC9H21O3P
Molecular Weight208.24 g/mol
Exact Mass208.12
IUPAC Name2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane
SMILESCOC(C)(C)P(=O)(OC)C(C)(C)C
InChIInChI=1S/C9H21O3P/c1-8(2,3)13(10,12-7)9(4,5)11-6/h1-7H3
InChIKeyMCPXFEYWHCOYDJ-UHFFFAOYSA-N
XLogP3.09
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 53.09
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-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane?
The IUPAC name of 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane (CID 59893550) is 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane.
What is the SMILES notation for 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane?
The canonical SMILES for 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane is COC(C)(C)P(=O)(OC)C(C)(C)C.
What is the InChIKey of 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane?
The InChIKey is MCPXFEYWHCOYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21O3P/c1-8(2,3)13(10,12-7)9(4,5)11-6/h1-7H3.
What are the key properties of 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane?
2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane has a molecular weight of 208.24 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methoxy(2-methoxypropan-2-yl)phosphoryl]-2-methylpropane is sourced from PubChem (CID 59893550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).