1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol

C14H24O2 — CID 106657616

IUPAC1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol
SMILESOC(CC1CCCO1)C1=CCCCCCC1
InChIInChI=1S/C14H24O2/c15-14(11-13-9-6-10-16-13)12-7-4-2-1-3-5-8-12/h7,13-15H,1-6,8-11H2
InChIKeyLQLLKVQAVIMUFB-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.20
Rot. Bonds3

About 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol

1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol (PubChem CID 106657616) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol.

Molecular Properties

Compound Name1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol
PubChem CID106657616
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol
SMILESOC(CC1CCCO1)C1=CCCCCCC1
InChIInChI=1S/C14H24O2/c15-14(11-13-9-6-10-16-13)12-7-4-2-1-3-5-8-12/h7,13-15H,1-6,8-11H2
InChIKeyLQLLKVQAVIMUFB-UHFFFAOYSA-N
XLogP3.20
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(cycloocten-1-yl)-2-(oxan-2-yl)ethanamine
CID 106654348
1-(cycloocten-1-yl)-2-cyclopropylethanol
CID 106657572
2-cyclobutyl-1-(cycloocten-1-yl)ethanol
CID 106657591
1-(2,3-dihydrofuran-4-yl)-2-(oxolan-2-yl)ethanol
CID 130580079
cyclohepten-1-yl(oxolan-2-yl)methanol
CID 62078402
1-(2,3-dihydrofuran-4-yl)-2-(oxan-2-yl)ethanol
CID 130580072
cycloocten-1-yl(cyclopropyl)methanol
CID 106651053
cyclohepten-1-yl(cyclopentyl)methanol
CID 62078752
1-(4-methylphenyl)-2-(oxolan-2-yl)ethanol
CID 60797370
cycloocten-1-yl-(2-methyloxolan-3-yl)methanol
CID 106657618
1-(4-fluoronaphthalen-1-yl)-2-(oxolan-2-yl)ethanol
CID 65157648
1-(cyclohexen-1-yl)-2-methylsulfanylethanol
CID 106657946

Frequently Asked Questions

What is the IUPAC name of 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol?
The IUPAC name of 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol (CID 106657616) is 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol.
What is the SMILES notation for 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol?
The canonical SMILES for 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol is OC(CC1CCCO1)C1=CCCCCCC1.
What is the InChIKey of 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol?
The InChIKey is LQLLKVQAVIMUFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c15-14(11-13-9-6-10-16-13)12-7-4-2-1-3-5-8-12/h7,13-15H,1-6,8-11H2.
What are the key properties of 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol?
1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol has a molecular weight of 224.34 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol is sourced from PubChem (CID 106657616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).