(8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol

C10H16O3 — CID 134906254

IUPAC(8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol
SMILESCC1=CCC2(OCCO2)C(CO)C1
InChIInChI=1S/C10H16O3/c1-8-2-3-10(9(6-8)7-11)12-4-5-13-10/h2,9,11H,3-7H2,1H3
InChIKeyVGXINUQBVOXULI-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.08
Rot. Bonds1

About (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol

(8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol (PubChem CID 134906254) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol.

Molecular Properties

Compound Name(8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol
PubChem CID134906254
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name(8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol
SMILESCC1=CCC2(OCCO2)C(CO)C1
InChIInChI=1S/C10H16O3/c1-8-2-3-10(9(6-8)7-11)12-4-5-13-10/h2,9,11H,3-7H2,1H3
InChIKeyVGXINUQBVOXULI-UHFFFAOYSA-N
XLogP1.08
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 ≤ 51.08
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

(2Z)-2-[(6S)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylcyclohex-3-en-1-ylidene]ethanol
CID 11107412
(E,4R,5R)-2,4-dimethyl-6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ene-1,5-diol
CID 46849798
(2R,3S,4S)-4-methyl-2-(2-methyl-1,3-dioxolan-2-yl)hex-5-en-3-ol
CID 71762816
(2S)-8-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,6-dimethyloct-6-en-1-ol
CID 123276701
2-Methyl-2-(1,2,3-trimethylcyclohex-3-en-1-yl)-1,3-dioxolane
CID 134979641
2-methyl-2-[(1S,6R)-1,2,3,6-tetramethylcyclohex-3-en-1-yl]-1,3-dioxolane
CID 134991349
(2Z)-2-[6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylcyclohex-3-en-1-ylidene]ethanol
CID 135042599
1,3-Dioxolane, 2-methyl-2-(4-methyl-3-cyclohexen-1-yl)-
CID 560036
Cyclohexane, 1,1-ethylenedioxy-2-(2-methyl-1-propenyl)-
CID 567459
7-Methyl-1,4-dioxaspiro[4.6]undec-7-en-10-ol
CID 10797572
3-(1,4-Dioxaspiro[4.5]dec-7-en-8-yl)propan-1-ol
CID 10845642
[2-(2,6-Dimethylhept-5-enyl)-1,3-dioxolan-4-yl]methanol
CID 14575177

Frequently Asked Questions

What is the IUPAC name of (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol?
The IUPAC name of (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol (CID 134906254) is (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol.
What is the SMILES notation for (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol?
The canonical SMILES for (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol is CC1=CCC2(OCCO2)C(CO)C1.
What is the InChIKey of (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol?
The InChIKey is VGXINUQBVOXULI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c1-8-2-3-10(9(6-8)7-11)12-4-5-13-10/h2,9,11H,3-7H2,1H3.
What are the key properties of (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol?
(8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol has a molecular weight of 184.23 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methyl-1,4-dioxaspiro[4.5]dec-8-en-6-yl)methanol is sourced from PubChem (CID 134906254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).