| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 220621-22-7 |
| FDA UNII: | 134PF6763Y |
| Category: | flavor and fragrance agents |
| IUPAC Name: | laevo-monomenthyl glutarate |
| InChI : | InChI=1/C15H26O4/c1-10(2)12-8-7-11(3)9-13(12)19-15(18)6-4-5-14(16)17/h10-13H,4-9H2,1-3H3,(H,16,17) |
| Std.InChI: | InChI=1S/C15H26O4/c1-10(2)12-8-7-11(3)9-13(12)19-15(18)6-4-5-14(16)17/h10-13H,4-9H2,1-3H3,(H,16,17) |
| InChIKey : | CTMTYSVTTGVYAW-UHFFFAOYAR |
| Std.InChIKey: | CTMTYSVTTGVYAW-UHFFFAOYSA-N |
| SMILES : | CC1CCC(C(C1)OC(=O)CCCC(=O)O)C(C)C |
| Molar Refractivity : | 72.87 ± 0.4 cm3 (est) |
| Parachor : | 640.8 ± 6.0 cm3 (est) |
| Index of Refraction : | 1.478 ± 0.03 (est) |
| Surface Tension : | 38.4 ± 5.0 dyne/cm (est) |
| Density : | 1.05 ± 0.1 g/cm3 (est) |
| Polarizability : | 28.88 ± 0.5 10-24cm3 (est) |
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
| JECFA Food Flavoring: | 1414 L-monomenthyl glutarate |
| DG SANTE Food Flavourings: | 09.929 L-monomenthyl glutarate |
| FEMA Number: | 4006 L-monomenthyl glutarate |
| FDA: | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF): | 220621-22-7 ; MONOMENTHYL GLUTARATE, L- |
| Appearance: | colorless clear viscous liquid (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.89400 to 0.90000 @ 20.00 °C. |
| Pounds per Gallon - (est).: | 7.448 to 7.498 |
| Specific Gravity: | 1.02600 to 1.03600 @ 25.00 °C. |
| Pounds per Gallon - est.: | 8.537 to 8.621 |
| Refractive Index: | 1.46500 to 1.47100 @ 20.00 °C. |
| Refractive Index: | 1.46200 to 1.47000 @ 20.00 °C. |
| Boiling Point: | 301.00 to 306.00 °C. @ 760.00 mm Hg |
| Acid Value: | 1.00 max. KOH/g |
| Flash Point: | 279.00 °F. TCC ( 137.22 °C. ) |
| logP (o/w): | 3.957 (est) |
| Soluble in: | |
| alcohol | |
| propylene glycol | |
| water, 5.088 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| None found |
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| None found. | |
| GHS Label elements, including precautionary statements | |
| Pictogram | |
| Hazard statement(s) | |
| None found. | |
| Precautionary statement(s) | |
| None found. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
| Category: | |||
| flavor and fragrance agents | |||
| RIFM Fragrance Material Safety Assessment: Search | |||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for laevo-monomenthyl glutarate usage levels up to: | |||
| 5.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 110.00 (μg/capita/day) | ||
| Threshold of Concern: | 1800 (μg/person/day) | ||
| Structure Class: | I | ||
| Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). | |||
| The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library | |||
| publication number: 20. Update in publication number(s): 26 | |||
| Click here to view publication 20 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | - | |
| beverages(nonalcoholic): | 50.00000 | 125.00000 | |
| beverages(alcoholic): | 50.00000 | 150.00000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | 1500.00000 | 8000.00000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | 200.00000 | 600.00000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | - | |
| fruit ices: | 40.00000 | 100.00000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | 300.00000 | 2000.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | - | - | |
| meat products: | - | - | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | 40.00000 | 80.00000 | |
| soft candy: | 250.00000 | 800.00000 | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
| European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): |
| Flavouring Group Evaluation 9, Revision 1: (FGE.09 Rev1)[1] - Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical groups 8 and 30, and an ester of a phenol carboxylic acid from chemical group 25 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
| Flavouring Group Evaluation 9, Revision 2 (FGE.09Rev2): Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical group 8 and 30, and an ester of a phenol derivative from chemical group 25 View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 9, Revision 3 (FGE.09Rev3): Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical group 8 and 30, and an ester of a phenol derivative from chemical group 25 View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 9, Revision 4 (FGE.09Rev4): Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical group 8 and 30, and an ester of a phenol derivative from chemical group 25 View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 9, Revision 5 (FGE.09Rev5): Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical group 8 and 30, and an ester of a phenol derivative from chemical group 25 View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 9, Revision 6 (FGE.09Rev6): Secondary alicyclic saturated and unsaturated alcohols, ketones and esters containing secondary alicyclic alcohols from chemical group 8 and 30, and an ester of a phenol derivative from chemical group 25 View page or View pdf |
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :10125362 |
| National Institute of Allergy and Infectious Diseases:Data |
| 5-(5-methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoic acid |
| Chemidplus:0220621227 |
| Leffingwell: | Chirality or Article |
| 5-(5-methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoic acid | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 10125362 |
| Pubchem (sid): | 39963803 |
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| FDA Substances Added to Food (formerly EAFUS): | View |
| HMDB (The Human Metabolome Database): | Search |
| FooDB: | FDB009910 |
| ChemSpider: | View |
| For Odor |
| camphoreous |
| thujyl alcohol FL/FR |
| verbenone FL/FR |
| mentholic |
dextro-neo mentholFL/FR |
(±)-iso menthoneFL/FR |
| minty |
(-)- menthoneFL/FR |
| For Flavor |
| No flavor group found for these |
| menthyl propylene glycol carbonate FL |
| verbenone FL/FR |
| thujyl alcohol FL/FR |
| cooling |
| cooling |
| WS-5 FL |
| mentholic |
dextro-neo mentholFL/FR |
| minty |
(±)-iso menthoneFL/FR |
(-)- menthoneFL/FR |
| FR | balsam |
| FL/FR | cornmint |
| FL | herbal |
| FL | mint |
| FL | peppermint |
| not found in nature |
| arctic MGT | |
| cooler 2 | |
| L-mono | menthan-3-yl glutarate |
| laevo-mono | menthan-3-yl glutarate |
| L-mono | menthane-3-yl glutarate |
| laevo-mono | menthane-3-yl glutarate |
| L-mono | menthyl glutarate |
| 5-{[5- | methyl-2-(propan-2-yl)cyclohexyl]oxy}-5-oxopentanoic acid |
| 5-(5- | methyl-2-propan-2-ylcyclohexyl)oxy-5-oxopentanoic acid |
| pentanedioic acid, mono[5-methyl-2-(1-methylethyl)cyclohexyl] ester | |
| rightcool monomenthyl glutarate |
