1,2-dimethoxy-2-methylpropane

C6H14O2 — CID 19389333

IUPAC1,2-dimethoxy-2-methylpropane
SMILESCOCC(C)(C)OC
InChIInChI=1S/C6H14O2/c1-6(2,8-4)5-7-3/h5H2,1-4H3
InChIKeyJKZCQJSIVSJSRT-UHFFFAOYSA-N
MW118.18 g/mol
LogP1.06
Rot. Bonds3

About 1,2-dimethoxy-2-methylpropane

1,2-dimethoxy-2-methylpropane (PubChem CID 19389333) has the molecular formula C6H14O2 and a molecular weight of 118.18 g/mol. Its IUPAC name is 1,2-dimethoxy-2-methylpropane.

Molecular Properties

Compound Name1,2-dimethoxy-2-methylpropane
PubChem CID19389333
Molecular FormulaC6H14O2
Molecular Weight118.18 g/mol
Exact Mass118.10
IUPAC Name1,2-dimethoxy-2-methylpropane
SMILESCOCC(C)(C)OC
InChIInChI=1S/C6H14O2/c1-6(2,8-4)5-7-3/h5H2,1-4H3
InChIKeyJKZCQJSIVSJSRT-UHFFFAOYSA-N
XLogP1.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethoxy-2-methylpropane?
The IUPAC name of 1,2-dimethoxy-2-methylpropane (CID 19389333) is 1,2-dimethoxy-2-methylpropane.
What is the SMILES notation for 1,2-dimethoxy-2-methylpropane?
The canonical SMILES for 1,2-dimethoxy-2-methylpropane is COCC(C)(C)OC.
What is the InChIKey of 1,2-dimethoxy-2-methylpropane?
The InChIKey is JKZCQJSIVSJSRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2/c1-6(2,8-4)5-7-3/h5H2,1-4H3.
What are the key properties of 1,2-dimethoxy-2-methylpropane?
1,2-dimethoxy-2-methylpropane has a molecular weight of 118.18 g/mol, XLogP of 1.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethoxy-2-methylpropane is sourced from PubChem (CID 19389333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).