2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane

C9H20O2 — CID 545850

IUPAC2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane
SMILESCC(C)(C)OCOC(C)(C)C
InChIInChI=1S/C9H20O2/c1-8(2,3)10-7-11-9(4,5)6/h7H2,1-6H3
InChIKeyPEVBHXMGGQHNIM-UHFFFAOYSA-N
MW160.26 g/mol
LogP2.57
Rot. Bonds2

About 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane

2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane (PubChem CID 545850) has the molecular formula C9H20O2 and a molecular weight of 160.26 g/mol. Its IUPAC name is 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane.

Molecular Properties

Compound Name2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane
PubChem CID545850
Molecular FormulaC9H20O2
Molecular Weight160.26 g/mol
Exact Mass160.15
IUPAC Name2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane
SMILESCC(C)(C)OCOC(C)(C)C
InChIInChI=1S/C9H20O2/c1-8(2,3)10-7-11-9(4,5)6/h7H2,1-6H3
InChIKeyPEVBHXMGGQHNIM-UHFFFAOYSA-N
XLogP2.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane?
The IUPAC name of 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane (CID 545850) is 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane.
What is the SMILES notation for 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane?
The canonical SMILES for 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane is CC(C)(C)OCOC(C)(C)C.
What is the InChIKey of 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane?
The InChIKey is PEVBHXMGGQHNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2/c1-8(2,3)10-7-11-9(4,5)6/h7H2,1-6H3.
What are the key properties of 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane?
2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane has a molecular weight of 160.26 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2-methylpropan-2-yl)oxymethoxy]propane is sourced from PubChem (CID 545850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).