3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol

C11H22O3 — CID 66367098

IUPAC3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol
SMILESCCOCCOC1CC(O)C1(C)CC
InChIInChI=1S/C11H22O3/c1-4-11(3)9(12)8-10(11)14-7-6-13-5-2/h9-10,12H,4-8H2,1-3H3
InChIKeyPVIPMZRDVQMXQI-UHFFFAOYSA-N
MW202.29 g/mol
LogP1.59
Rot. Bonds6

About 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol

3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol (PubChem CID 66367098) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol.

Molecular Properties

Compound Name3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol
PubChem CID66367098
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol
SMILESCCOCCOC1CC(O)C1(C)CC
InChIInChI=1S/C11H22O3/c1-4-11(3)9(12)8-10(11)14-7-6-13-5-2/h9-10,12H,4-8H2,1-3H3
InChIKeyPVIPMZRDVQMXQI-UHFFFAOYSA-N
XLogP1.59
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol?
The IUPAC name of 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol (CID 66367098) is 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol.
What is the SMILES notation for 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol?
The canonical SMILES for 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol is CCOCCOC1CC(O)C1(C)CC.
What is the InChIKey of 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol?
The InChIKey is PVIPMZRDVQMXQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-4-11(3)9(12)8-10(11)14-7-6-13-5-2/h9-10,12H,4-8H2,1-3H3.
What are the key properties of 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol?
3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol has a molecular weight of 202.29 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol is sourced from PubChem (CID 66367098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).