1-(2-methoxyethoxy)-2,2-dimethylpropane

C8H18O2 — CID 14474431

IUPAC1-(2-methoxyethoxy)-2,2-dimethylpropane
SMILESCOCCOCC(C)(C)C
InChIInChI=1S/C8H18O2/c1-8(2,3)7-10-6-5-9-4/h5-7H2,1-4H3
InChIKeyDSWOBIURRPASDR-UHFFFAOYSA-N
MW146.23 g/mol
LogP1.70
Rot. Bonds4

About 1-(2-methoxyethoxy)-2,2-dimethylpropane

1-(2-methoxyethoxy)-2,2-dimethylpropane (PubChem CID 14474431) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is 1-(2-methoxyethoxy)-2,2-dimethylpropane.

Molecular Properties

Compound Name1-(2-methoxyethoxy)-2,2-dimethylpropane
PubChem CID14474431
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Name1-(2-methoxyethoxy)-2,2-dimethylpropane
SMILESCOCCOCC(C)(C)C
InChIInChI=1S/C8H18O2/c1-8(2,3)7-10-6-5-9-4/h5-7H2,1-4H3
InChIKeyDSWOBIURRPASDR-UHFFFAOYSA-N
XLogP1.70
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxy)-2,2-dimethylpropane?
The IUPAC name of 1-(2-methoxyethoxy)-2,2-dimethylpropane (CID 14474431) is 1-(2-methoxyethoxy)-2,2-dimethylpropane.
What is the SMILES notation for 1-(2-methoxyethoxy)-2,2-dimethylpropane?
The canonical SMILES for 1-(2-methoxyethoxy)-2,2-dimethylpropane is COCCOCC(C)(C)C.
What is the InChIKey of 1-(2-methoxyethoxy)-2,2-dimethylpropane?
The InChIKey is DSWOBIURRPASDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2/c1-8(2,3)7-10-6-5-9-4/h5-7H2,1-4H3.
What are the key properties of 1-(2-methoxyethoxy)-2,2-dimethylpropane?
1-(2-methoxyethoxy)-2,2-dimethylpropane has a molecular weight of 146.23 g/mol, XLogP of 1.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxy)-2,2-dimethylpropane is sourced from PubChem (CID 14474431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).