2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane

C8H19O3P — CID 171057571

IUPAC2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
SMILESCC(C)OP(C)(=O)OC(C)(C)C
InChIInChI=1S/C8H19O3P/c1-7(2)10-12(6,9)11-8(3,4)5/h7H,1-6H3
InChIKeyACCFKKOHVUUZQD-UHFFFAOYSA-N
MW194.21 g/mol
LogP3.05
Rot. Bonds3

About 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane

2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane (PubChem CID 171057571) has the molecular formula C8H19O3P and a molecular weight of 194.21 g/mol. Its IUPAC name is 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane.

Molecular Properties

Compound Name2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
PubChem CID171057571
Molecular FormulaC8H19O3P
Molecular Weight194.21 g/mol
Exact Mass194.11
IUPAC Name2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
SMILESCC(C)OP(C)(=O)OC(C)(C)C
InChIInChI=1S/C8H19O3P/c1-7(2)10-12(6,9)11-8(3,4)5/h7H,1-6H3
InChIKeyACCFKKOHVUUZQD-UHFFFAOYSA-N
XLogP3.05
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[dimethylphosphoryloxy(methyl)phosphoryl]oxypropane
CID 158432359
tert-butyl [hydroxy-[hydroxy(propan-2-yloxy)phosphoryl]oxyphosphoryl] hydrogen phosphate
CID 129302859
2-dimethylphosphoryloxypropane
CID 12572720
2-[fluoro(methyl)phosphoryl]oxy-2-methylpropane
CID 567264
(3R)-3-[chloro(methyl)phosphoryl]oxy-2,2-dimethylbutane
CID 129373323
2-chloro-2-[fluoro(propan-2-yloxy)phosphoryl]propane
CID 151495462
CID 175885039
CID 175885039
ethene;2-[fluoro(methyl)phosphoryl]oxypropane
CID 174612672
[methyl-[(2-methylpropan-2-yl)oxy]phosphoryl] prop-2-enoate
CID 174794227
methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane
CID 167648199
1,1-dichloro-1-[1,1-dichloroethoxy(methyl)phosphoryl]oxyethane
CID 19814535
copper bis(dipropan-2-yl phosphate)
CID 159825108

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane?
The IUPAC name of 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane (CID 171057571) is 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane.
What is the SMILES notation for 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane?
The canonical SMILES for 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane is CC(C)OP(C)(=O)OC(C)(C)C.
What is the InChIKey of 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane?
The InChIKey is ACCFKKOHVUUZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19O3P/c1-7(2)10-12(6,9)11-8(3,4)5/h7H,1-6H3.
What are the key properties of 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane?
2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane has a molecular weight of 194.21 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane is sourced from PubChem (CID 171057571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).