Grundinformationen
- CAS
490-03-9- Standard-SMILES
CC1=C(O)C(=O)C(C(C)C)CC1- InChIKey
QSIMLPCPCXVYDD-UHFFFAOYSA-N- Summenformel
- C10H16O2
- Durchschnittliche Molmasse
- 168,23 g/mol
- Monoisotopische Masse
- 168,11502975
Überblick
Diosphenol is a cyclic monoterpene ketone that is cyclohex-2-en-1-one substituted by a hydroxy group at position 2, a methyl group at position 3 and an isopropyl group at position 6. It has a role as a plant metabolite. It is a cyclic monoterpene ketone and an enol.
Namen und Bezeichner
- Bevorzugter Name
- 2-Hydroxypiperitone
- IUPAC
- 2-hydroxy-3-methyl-6-propan-2-ylcyclohex-2-en-1-one
- Lokaler Name
- 2-Hydroxy-6-(isopropyl)-3-methylcyclohex-2-en-1-on
- Englischer Name
- 2-hydroxy-6-(isopropyl)-3-methylcyclohex-2-en-1-one
- Summenformel
- C10H16O2
- Molmasse
- 168.23
Namen und Synonyme
Diosphenol490-03-92-HydroxypiperitoneBarosma camphorBuchu camphorBuccocamphor1-p-menthen-2-ol-3-one2-hydroxy-3-methyl-6-(propan-2-yl)cyclohex-2-en-1-oneUNII-4221SIG7EK4221SIG7EKEINECS 207-704-92-Hydroxy-6-isopropyl-3-methyl-2-cyclohexen-1-one
Weitere Namen anzeigen
2-HYDROXY-PARA-MENTH-1-EN-3-ONE2-hydroxy-6-(isopropyl)-3-methylcyclohex-2-en-1-one2-hydroxy-3-methyl-6-propan-2-ylcyclohex-2-en-1-one2-hydroxy-3-methyl-6-propan-2-yl-cyclohex-2-en-1-one2-Cyclohexen-1-one,2-hydroxy-3-methyl-6-(1-methylethyl)-
2-HYDROXY-P-MENTH-1-EN-3-ONECHEBI:4632FEMA NO. 41431-methyl-4-isopropyl-1-cyclohexen-2-ol-3-one2-Hydroxy-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-one2-HYDROXY-6-ISOPROPYL-3-METHYLCYCLOHEX-2-ENONERefChem:258392-Cyclohexen-1-one, 2-hydroxy-3-methyl-6-(1-methylethyl)-
Datenbank-Bezeichner
- CAS
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2
- Polarare Oberfläche (TPSA)
- 37,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 226
Experimentelle und physikochemische Eigenschaften
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Flavoring AgentsEU Flavoring substances
Solubility
Slightly soluble in water
Soluble (in ethanol)
Boiling Point231-233 °C
Physical DescriptionColourless to pale yellow crystals; Minty tea aroma
Physikochemische Eigenschaften
- Schmelzpunkt
- 83 ° · 83°
- Siedepunkt
- 760 · bp760 233° (dec); bp10 109°
- Dichte
- 499.2 · d499.2 0.9542
- FEMA
- 4143 · 4143 | (+/-)-2-HYDROXYPIPERITONE
- Brechungsindex
- 99.8 · nD99.8 1.4607
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 98.9% (89 of 90) of all reports.
Not Classified
Aggregated GHS information provided per 90 reports by companies from 2 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 2-Cyclohexen-1-one, 2-hydroxy-3-methyl-6-(1-methylethyl)-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
2-Cyclohexen-1-one, 2-hydroxy-3-methyl-6-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Sicherheitsdaten
- tsca
- TSCA listed
Chemie und Industrie
Verwendung und Herstellung
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing Information2-Cyclohexen-1-one, 2-hydroxy-3-methyl-6-(1-methylethyl)-: ACTIVE
Anwendungen
OccurrenceReported found in buchu leaf and buchu leaf oil (22.3%).
VerwendenHas occasionally found use in flavor compositions, years ago in various toothpaste flavor compositions, but the author believes that the use of Diosphenol in flavors has been practically abandoned. The natural oil, Buchu leaf oil, is still used in various types of Mint flavor, particularly in Europe and South Africa.
Anbieter10 Anbieter
常州宣叶科技有限公司15195022192 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
career henan chemical co
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