Grundinformationen
- Standard-SMILES
CC1=CCC(CCO)C1(C)C- InChIKey
NPGPPCSBEMHHCR-UHFFFAOYSA-N- Summenformel
- C10H18O
- Durchschnittliche Molmasse
- 154,25 g/mol
- Monoisotopische Masse
- 154,1357652
Überblick
See also: (+)-Campholenol (annotation moved to).
Namen und Bezeichner
- Bevorzugter Name
- alpha-CAMPHOLENOL
- IUPAC
- 2-(2,2,3-trimethylcyclopent-3-en-1-yl)ethanol
- Lokaler Name
- 2,2,3-Trimethylcyclopent-3-en-1-ethanol
- Englischer Name
- 2,2,3-trimethylcyclopent-3-ene-1-ethanol
- Summenformel
- C10H18O
- Molmasse
- 154.25
Namen und Synonyme
alpha-Campholenol1901-38-82-(2,2,3-Trimethylcyclopent-3-en-1-yl)ethanol2,2,3-Trimethylcyclopent-3-ene-1-ethanol.alpha.-CampholenolNaturanolCampholenic alcohol, alpha-alpha-campholenic alcoholCampholenol, alpha-FEMA No. 37413-Cyclopentene-1-ethanol, 2,2,3-trimethyl-TRIMENOL
Weitere Namen anzeigen
ALPHA-CAMPHOLENICALCOHOL2,2,3-Trimethylcyclopenta-3-ene-1-ethanol2-(2,2,3-Trimethylcyclopent-3-enyl)ethanol
9H6329UALZEINECS 217-600-52,2,3-TRIMETHYL-3-CYCLOPENTENE-1-ETHANOLRefChem:555424(+-)-CAMPHOLENE ALCOHOLCAMPHOLENE ALCOHOL, (+-)-217-600-5Campholenic alcohol
Datenbank-Bezeichner
- CAS
1901-38-8、52437-39-5- PubChem CID
- 61284
- DTXSID
DTXSID30862779- UNII
- 9H6329UALZ
- EC Number
- 217-600-5
- Nikkaji
- J13.018D
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,1
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 168
Experimentelle und physikochemische Eigenschaften
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.882-0.894 (20 °C)
Flavoring AgentsEU Flavoring substances
Solubility
slightly
Slightly soluble in water; soluble in fat
Miscible at room temperature (in ethanol)
Boiling Point
74.00 °C. @ 0.60 mm Hg
74 °C (0.6 mm Hg)
Refractive Index1.470-1.478
Physical DescriptionColourless liquid; sweet, berry, camphoraceous odour
Physikochemische Eigenschaften
- Siedepunkt
- 132 °C · 132 °C
- Dichte
- 0.889 · 0.889
- FEMA
- 3741 · 3741 | ALPHA-CAMPHOLENIC ALCOHOL
- pka
- 15.09 · 15.09±0.10(Predicted)
- Geruch (Odor)
- 100 % · at 100.00 %. sweet berry camphor
- Geruchsart
- camphoreous
- JECFA Number
- 970 · 970
- LogP
- 3.05 · 3.05
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.
Not Classified
Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory Information
Chemical: 3-Cyclopentene-1-ethanol, 2,2,3-trimethyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
3-Cyclopentene-1-ethanol, 2,2,3-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsExtracellular
Verwendung und Herstellung
Use Classification
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Anwendungen
OccurrenceReported found in black raspberries and rosemary.
Anbieter5 Anbieter
上海恩诺生物科技有限公司+86 (21) 6435-5022
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
海蔚化学86-21-51086038 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
重庆卡兰医药有限公司[email protected]
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