Grundinformationen
- CAS
2153-26-6- Standard-SMILES
CC1=CCC(C(C)(C)OC=O)CC1- InChIKey
IPYLQIQMGUZFCK-UHFFFAOYSA-N- Summenformel
- C11H18O2
- Durchschnittliche Molmasse
- 182,26 g/mol
- Monoisotopische Masse
- 182,13067981
Überblick
Alpha-Terpineol formate is a p-menthane monoterpenoid.
Namen und Bezeichner
- Bevorzugter Name
- Terpinyl formate
- IUPAC
- 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl formate
- Lokaler Name
- p-Menth-1-en-8-ylformiat
- Englischer Name
- TERPINYL FORMATE
- Summenformel
- C11H18O2
- Molmasse
- 182.26
Namen und Synonyme
Terpinyl formate2153-26-6p-1-Menthen-8-yl formatealpha-Terpinyl formateP-Menth-1-en-8-yl formateFEMA No. 3052P-Menth-1-en-8-ol, formatep-menth-1-en-8-yl-formateGTJ0954O31EINECS 218-444-0alpha,alpha,4-Trimethyl-3-cyclohexene-1-methyl formateTERPINYL FORMATE [FHFI]
Weitere Namen anzeigen
FEMA 3052ALPHA TERPINYL FORMATEp-1-Menthen-8-ylformatep-menth-1-en-8-ylformatep-Menth-1-en-8-ylformiatFormic acid p-menth-1-en-8-yl esterTerpinyl formate, mixture of isomersp-menth-1-en-8-ol,formate(mixedisomers)TERPINYL FORMATE 97+% MIXTURE OF &
3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, formate.ALPHA.-TERPINYL FORMATEDTXSID208628493-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, formate3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, 1-formate3-CYCLOHEXENE-1-METHANOL, .ALPHA.,.ALPHA.,4-TRIMETHYL-, 1-3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, 1-formateRefChem:891482
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 216
Experimentelle und physikochemische Eigenschaften
FragrancesFragrance Ingredient (Terpinyl formate) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.987-0.993 (15.5 °C)
Flavoring AgentsEU Flavoring substances
Solubility
very slightly
very slightly soluble in water
1 ml in 6 ml 60% alcohol (in ethanol)
Boiling Point
213.00 to 225.00 °C. @ 760.00 mm Hg
213-225 °C
Refractive Index1.467-1.473
Physical Descriptioncolourless liquid with a floral citrusy, tart, herbaceous odour
Physikochemische Eigenschaften
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 18.2% (294 of 1619) of reports.
H412 (79.4%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1619 reports by companies from 4 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, formate
3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, formate: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, formate: Environment tier I assessment
Hazard Classes and CategoriesAquatic Chronic 3 (79.4%)
Sicherheitsdaten
- wgk
- 2
- tsca
- TSCA listed
- RTECS-Nr.
- OT0220000
- risk_code
- 36/37/38
- Toxizität
- Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Moreno, 1976).
- hazard_code
- Xi
- safety_code
- 26-36
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsExtracellular
Verwendung und Herstellung
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing Information3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, 1-formate: ACTIVE
Anwendungen
OccurrenceReported present in Ceylon cardamom essential oil.
VerwendenTerpinyl formate finds some use in Citrus-colognes, in support of Neroli notes, Lavender-Bergamot-notes, green notes, etc. It is also used in certain topnote compositions with Citrus oils and "green" materials.
Darstellung
synthetischeBy cold formylation of terpineol, using formic-acetic anhydride (Arctander, 1969). Uses: In public use before the 1920s. Use in fragrances in the USA amounts to approximately 10001b/yr.
Anbieter6 Anbieter
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
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