3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol

C12H24O4 — CID 104675355

IUPAC3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol
SMILESCCCCOCCOC1CC(O)C1OCC
InChIInChI=1S/C12H24O4/c1-3-5-6-14-7-8-16-11-9-10(13)12(11)15-4-2/h10-13H,3-9H2,1-2H3
InChIKeyRPTGXRWYCRFJPQ-UHFFFAOYSA-N
MW232.32 g/mol
LogP1.36
Rot. Bonds9

About 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol

3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol (PubChem CID 104675355) has the molecular formula C12H24O4 and a molecular weight of 232.32 g/mol. Its IUPAC name is 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol.

Molecular Properties

Compound Name3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol
PubChem CID104675355
Molecular FormulaC12H24O4
Molecular Weight232.32 g/mol
Exact Mass232.17
IUPAC Name3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol
SMILESCCCCOCCOC1CC(O)C1OCC
InChIInChI=1S/C12H24O4/c1-3-5-6-14-7-8-16-11-9-10(13)12(11)15-4-2/h10-13H,3-9H2,1-2H3
InChIKeyRPTGXRWYCRFJPQ-UHFFFAOYSA-N
XLogP1.36
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-propoxy-3-(2-propoxyethoxy)cyclobutan-1-ol
CID 107942594
3-(2-cyclopropylethoxy)-2-ethoxycyclobutan-1-ol
CID 106207193
2-methoxy-3-[2-(3-methoxypropoxy)ethoxy]cyclobutan-1-ol
CID 103176139
3-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]oxan-4-ol
CID 104564775
3-(2-butoxyethoxy)-N-methyl-2-propoxycyclobutan-1-amine
CID 107943466
2-butoxycyclobutan-1-ol
CID 123438323
2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
CID 107942629
2-butoxyethoxycyclobutane
CID 150038799
1-bromo-3-(2-butoxyethoxy)cyclobutane
CID 66345122
1-chloro-2-ethoxy-3-(2-ethoxyethoxy)cyclobutane
CID 104675598
2-ethoxy-3-pentan-2-yloxycyclobutan-1-ol
CID 102988633
3-(2-cyclopropylethoxy)-2-(2-methoxyethoxy)cyclobutan-1-ol
CID 106207201

Frequently Asked Questions

What is the IUPAC name of 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol?
The IUPAC name of 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol (CID 104675355) is 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol.
What is the SMILES notation for 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol?
The canonical SMILES for 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol is CCCCOCCOC1CC(O)C1OCC.
What is the InChIKey of 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol?
The InChIKey is RPTGXRWYCRFJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O4/c1-3-5-6-14-7-8-16-11-9-10(13)12(11)15-4-2/h10-13H,3-9H2,1-2H3.
What are the key properties of 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol?
3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol has a molecular weight of 232.32 g/mol, XLogP of 1.36, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol is sourced from PubChem (CID 104675355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).