2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol

C10H18O3 — CID 11805458

IUPAC2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol
SMILESOCCC1CCC2(CC1)OCCO2
InChIInChI=1S/C10H18O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h9,11H,1-8H2
InChIKeyTXUGEISFHODXQL-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.30
Rot. Bonds2

About 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol

2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol (PubChem CID 11805458) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol.

Molecular Properties

Compound Name2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol
PubChem CID11805458
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol
SMILESOCCC1CCC2(CC1)OCCO2
InChIInChI=1S/C10H18O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h9,11H,1-8H2
InChIKeyTXUGEISFHODXQL-UHFFFAOYSA-N
XLogP1.30
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-Methyl-1,3-dioxolan-2-yl)hexan-1-ol
CID 110694
1,4-Dioxaspiro[4.5]decan-8-ylmethanol
CID 10080838
2-Cyclohexyl-2-methyl-1,3-dioxolane-4-methanol
CID 21900
1,4-Dioxaspiro[4.5]decan-6-ylmethanol
CID 4066558
8-Methyl-1,4-dioxaspiro[4.5]decane
CID 10953772
4-(1,3-Dioxolan-2-yl)cyclohexan-1-ol
CID 14296101
1,4-Dioxaspiro[4.5]decane-6-ethanol
CID 15566391
8-Ethyl-1,4-dioxaspiro[4.5]decane
CID 21016596
(8S)-7-fluoro-8-propyl-1,4-dioxaspiro[4.5]decane
CID 54046014
2-(1,4-Dioxaspiro[4.5]decan-8-yl)-2,2-difluoroethanol
CID 163240184
1,4-Dioxaspiro[4.5]decane-7-methanol
CID 588050
1,4-Dioxaspiro[4.5]decane-7-ethanol, (7S)-
CID 11206230

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol?
The IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol (CID 11805458) is 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol.
What is the SMILES notation for 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol?
The canonical SMILES for 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol is OCCC1CCC2(CC1)OCCO2.
What is the InChIKey of 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol?
The InChIKey is TXUGEISFHODXQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h9,11H,1-8H2.
What are the key properties of 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol?
2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol has a molecular weight of 186.25 g/mol, XLogP of 1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dioxaspiro[4.5]decan-8-yl)ethanol is sourced from PubChem (CID 11805458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).