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

C10H16O3 — CID 10976162

IUPAC2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol
SMILESOCC=C1CCC2(CC1)OCCO2
InChIInChI=1S/C10H16O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h3,11H,1-2,4-8H2
InChIKeyFZDKNEOUCWHORQ-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.22
Rot. Bonds1

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

2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol (PubChem CID 10976162) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol.

Molecular Properties

Compound Name2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol
PubChem CID10976162
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol
SMILESOCC=C1CCC2(CC1)OCCO2
InChIInChI=1S/C10H16O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h3,11H,1-2,4-8H2
InChIKeyFZDKNEOUCWHORQ-UHFFFAOYSA-N
XLogP1.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8-Propylidene-1,4-dioxaspiro[4.5]decane
CID 102119364
(E)-3-[(3S)-1,4-dioxaspiro[4.5]decan-3-yl]prop-2-en-1-ol
CID 10488185
(2Z)-2-[(6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylcyclohex-3-en-1-ylidene]ethanol
CID 11107412
8-(6-Methylhept-5-en-2-ylidene)-1,4-dioxaspiro[4.5]decane
CID 135005805
(1R)-1-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]but-2-en-1-ol
CID 135038087
(2Z)-2-[6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylcyclohex-3-en-1-ylidene]ethanol
CID 135042599
(2e,5s)-5-[(2r)-1,4-Dioxaspiro[4.5]dec-2-yl]-5(methoxymethoxy)pent-2-en-1-ol
CID 139210701
2-Penten-1-ol, 5-(1,3-dioxolan-2-yl)-3-methyl-, (E)-
CID 5366368
(E)-3-methyl-5-[(4S)-2,2,5,5-tetramethyl-1,3-dioxolan-4-yl]pent-2-en-1-ol
CID 6364641
(E)-2-methyl-5-(2-methyl-1,3-dioxolan-2-yl)pent-2-en-1-ol
CID 10559466
3-(2-Methyl-1,3-dioxolan-2-yl)cyclohex-2-en-1-ol
CID 10954213
(Z)-2-methyl-5-(2-methyl-[1,3]dioxolan-2-yl)-pent-2-en-1-ol
CID 12402778

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol?
The IUPAC name of 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol (CID 10976162) is 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol.
What is the SMILES notation for 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol?
The canonical SMILES for 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol is OCC=C1CCC2(CC1)OCCO2.
What is the InChIKey of 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol?
The InChIKey is FZDKNEOUCWHORQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h3,11H,1-2,4-8H2.
What are the key properties of 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol?
2-(1,4-dioxaspiro[4.5]decan-8-ylidene)ethanol has a molecular weight of 184.23 g/mol, XLogP of 1.22, 1 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-ylidene)ethanol is sourced from PubChem (CID 10976162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).