Menthone glycerin acetal

C₁₃H₂₄O₃CAS 63187-91-7228.33 g/mol

Open in Covalent MOL file

Acetal Alcohol Ether

Properties

Molecular formula: C₁₃H₂₄O₃
Molar mass: 228.33 g/mol
Exact mass: 228.1725 Da
Density: 1.0308 g/mL
Boiling point: 148–152 °C (at 14 Torr)
logP: 2.18Crippen estimate
Polar surface area: 38.7 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Hazards

Danger

H315 Causes skin irritationSkin corrosion/irritation
H318 Causes serious eye damageSerious eye damage/eye irritation
H412 Harmful to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 603-132-00-2), via PubChem.

Precautionary statements

P264, P264+P265, P273, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, P362+P364, P501

Identifiers

CAS number

63187-91-7

SMILES

CC1CCC(C(C)C)C2(C1)OCC(CO)O2

InChIKey

ZBJCYZPANVLBRK-UHFFFAOYSA-N

InChI

InChI=1S/C13H24O3/c1-9(2)12-5-4-10(3)6-13(12)15-8-11(7-14)16-13/h9-12,14H,4-8H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

10 names

1,4-Dioxaspiro[4.5]decane-2-methanol, 9-methyl-6-(1-methylethyl)-
9-Methyl-6-(1-methylethyl)-1,4-dioxaspiro[4.5]decane-2-methanol
Frescolat MGA
Menthone glyceryl ketal
6-Isopropyl-9-methyl-1,4-dioxaspiro[4,5]decane-2-methanol
(6-Isopropyl-9-methyl-1,4-dioxaspiro[4.5]decan-2-yl)methanol
Fema gras 3808
Menthone glycerine acetal
(9-Methyl-6-propan-2-yl-1,4-dioxaspiro[4.5]decan-3-yl)methanol
[9-Methyl-6-(propan-2-yl)-1,4-dioxaspiro[4.5]decan-2-yl]methanol

Work with Menthone glycerin acetal

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Solketal100-79-841 % similar (R)-Solketal14347-78-541 % similar (+)-Solketal22323-82-641 % similar 3-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-1,2-propanediol87061-04-932 % similar 2-Methyl-1-pentanol105-30-630 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Menthyl lactate17162-29-7 Glycidyl neodecanoate26761-45-5 l-Menthyl D-lactate59259-38-0 L-Menthyl L-lactate61597-98-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook