2-(8-ethyloxocan-2-yl)ethanol

C11H22O2 — CID 14445090

IUPAC2-(8-ethyloxocan-2-yl)ethanol
SMILESCCC1CCCCCC(CCO)O1
InChIInChI=1S/C11H22O2/c1-2-10-6-4-3-5-7-11(13-10)8-9-12/h10-12H,2-9H2,1H3
InChIKeyQLUHOMGITFYRMI-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.50
Rot. Bonds3

About 2-(8-ethyloxocan-2-yl)ethanol

2-(8-ethyloxocan-2-yl)ethanol (PubChem CID 14445090) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-(8-ethyloxocan-2-yl)ethanol.

Molecular Properties

Compound Name2-(8-ethyloxocan-2-yl)ethanol
PubChem CID14445090
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-(8-ethyloxocan-2-yl)ethanol
SMILESCCC1CCCCCC(CCO)O1
InChIInChI=1S/C11H22O2/c1-2-10-6-4-3-5-7-11(13-10)8-9-12/h10-12H,2-9H2,1H3
InChIKeyQLUHOMGITFYRMI-UHFFFAOYSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2R,6S)-6-tert-butyloxan-2-yl]ethanol
CID 130978706
ethane;2-ethyl-6-(methoxymethyl)oxane
CID 145297456
(6-ethyloxan-2-yl)-trimethylsilane
CID 13214712
(2R)-2-ethyl-6-methoxyoxane
CID 15250108
2-(5,6-dimethyloxan-2-yl)ethanol
CID 59772049
ethane;2-(2-propyl-1,3-dioxan-4-yl)ethanol
CID 145311557
2-ethyl-5-(iodomethyl)oxolane
CID 130582736
3-[5-(3-hydroxypropyl)oxolan-2-yl]propan-1-ol
CID 20529882
1-cyclohexyl-2-[(2R,6R)-6-hexyloxan-2-yl]ethanone
CID 101197924
(2R,6R)-6-butyloxan-2-ol
CID 130757753
2-(oxolan-2-yl)ethanol;propan-2-one
CID 70356947
ethane-1,2-diol;2-ethyloxirane
CID 23290341

Frequently Asked Questions

What is the IUPAC name of 2-(8-ethyloxocan-2-yl)ethanol?
The IUPAC name of 2-(8-ethyloxocan-2-yl)ethanol (CID 14445090) is 2-(8-ethyloxocan-2-yl)ethanol.
What is the SMILES notation for 2-(8-ethyloxocan-2-yl)ethanol?
The canonical SMILES for 2-(8-ethyloxocan-2-yl)ethanol is CCC1CCCCCC(CCO)O1.
What is the InChIKey of 2-(8-ethyloxocan-2-yl)ethanol?
The InChIKey is QLUHOMGITFYRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-2-10-6-4-3-5-7-11(13-10)8-9-12/h10-12H,2-9H2,1H3.
What are the key properties of 2-(8-ethyloxocan-2-yl)ethanol?
2-(8-ethyloxocan-2-yl)ethanol has a molecular weight of 186.29 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-ethyloxocan-2-yl)ethanol is sourced from PubChem (CID 14445090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).