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

C11H24O3 — CID 59476803

IUPAC2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane
SMILESCC(C)(C)OCCOCOC(C)(C)C
InChIInChI=1S/C11H24O3/c1-10(2,3)13-8-7-12-9-14-11(4,5)6/h7-9H2,1-6H3
InChIKeyNJHYIOGPKLKCSH-UHFFFAOYSA-N
MW204.31 g/mol
LogP2.59
Rot. Bonds5

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

2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane (PubChem CID 59476803) has the molecular formula C11H24O3 and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane.

Molecular Properties

Compound Name2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane
PubChem CID59476803
Molecular FormulaC11H24O3
Molecular Weight204.31 g/mol
Exact Mass204.17
IUPAC Name2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane
SMILESCC(C)(C)OCCOCOC(C)(C)C
InChIInChI=1S/C11H24O3/c1-10(2,3)13-8-7-12-9-14-11(4,5)6/h7-9H2,1-6H3
InChIKeyNJHYIOGPKLKCSH-UHFFFAOYSA-N
XLogP2.59
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane?
The IUPAC name of 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane (CID 59476803) is 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane.
What is the SMILES notation for 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane?
The canonical SMILES for 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane is CC(C)(C)OCCOCOC(C)(C)C.
What is the InChIKey of 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane?
The InChIKey is NJHYIOGPKLKCSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3/c1-10(2,3)13-8-7-12-9-14-11(4,5)6/h7-9H2,1-6H3.
What are the key properties of 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane?
2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane has a molecular weight of 204.31 g/mol, XLogP of 2.59, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[2-[(2-methylpropan-2-yl)oxymethoxy]ethoxy]propane is sourced from PubChem (CID 59476803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).