Nopol
Grundinformationen
- CAS
128-50-7- Standard-SMILES
CC1(C)C2CC=C(CCO)C1C2- InChIKey
ROKSAUSPJGWCSM-UHFFFAOYSA-N- Summenformel
- C11H18O
- Durchschnittliche Molmasse
- 166,26 g/mol
- Monoisotopische Masse
- 166,1357652
Überblick
nopol has been reported in Daucus carota with data available.
Namen und Bezeichner
- Bevorzugter Name
- Nopol
- IUPAC
- 2-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)ethanol
- Lokaler Name
- Nopol
- Englischer Name
- NOPOL
- Summenformel
- C11H18O
- Molmasse
- 166.26
Namen und Synonyme
Nopol128-50-7Nopol (terpene)6,6-Dimethyl-2-norpinene-2-ethanolBicyclo[3.1.1]hept-2-ene-2-ethanol, 6,6-dimethyl-XK8HU7WJQCBicyclo(3.1.1)hept-2-ene-2-ethanol, 6,6-dimethyl-DTXSID108617802-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)ethanol2-(6,6-dimethyl-2-bicyclo(3.1.1)hept-2-enyl)ethanolRefChem:854687DTXCID00810661
Weitere Namen anzeigen
HomomyrtenolNOPOL 98%nopol(terpene)METHYLOL PINENE10-HYDROXYMETHYLENE-2-PINENE6-dimethyl-2-norpinene-2-ethano6,6-dimethyl-2-norpinene-2-ethano
204-890-32-{6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}ethan-1-ol6,6-Dimethyl-2-(2-hydroxyethyl)-2-norpineneHomomyretenol2-Norpinene-2-ethanol,6-dimethyl-MFCD000664196,6-DIMETHYLBICYCLO(3.1.1)HEPT-2-ENE-2-ETHANOLBicyclo[3.1.1]hept-2-ene-2-ethanol,6-dimethyl-
Datenbank-Bezeichner
- CAS
128-50-7、35836-73-8- PubChem CID
- 31408
- DTXSID
DTXSID10861780- ChEMBL
CHEMBL257332- EC Number
- 204-890-3
- Nikkaji
- J21.520A
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
- 12
- Formalladung
- 0
- Komplexität
- 215
Experimentelle und physikochemische Eigenschaften
PolymersOther Classes -> Alcohols and Polyols, Other
FragrancesFragrance Ingredient (Nopol) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.965-0.973
Flavoring AgentsEU Flavoring substances
Solubility
Insoluble in water; soluble in organic solvents and oils
Miscible at room temperature (in ethanol)
Boiling Point
230.00 to 240.00 °C. @ 760.00 mm Hg
230 °C
Refractive Index1.490-1.500
Physical Description
Colorless viscous liquid; [Acros Organics MSDS]
Colroless, slight viscous liquid; mild woody camphoraceous odour
Physikochemische Eigenschaften
- Siedepunkt
- 230 · 230-240 °C
- Dichte
- 0.973 · 0.973
- FEMA
- 3938 · 3938 | 10-HYDROXYMETHYLENE-2-PINENE
- Brechungsindex
- 1.492 · 1.492-1.494
- Flammpunkt
- 98 °C · 98 °C
- pka
- 15.03 · 15.03±0.10(Predicted)
- Geruch (Odor)
- 100 % · at 100.00 %. sweet balsamic citrus pine herbal
- Geruchsart
- balsamic
- JECFA Number
- 986 · 986
- Major Application
- flavors and fragrances
- Kosmetik-Inhaltsstoffe Funktionen
- PERFUMING
- InChI
- 1S/C11H18O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h3,9-10,12H,4-7H2,1-2H3
- InChIKey
- ROKSAUSPJGWCSM-UHFFFAOYSA-N
- SMILES
- OCCC1=CCC2CC1C2(C)C
- LogP
- 3.09 · 3.09
- EPA chemische Informationen
- 3.1 · Bicyclo[3.1.1]hept-2-ene-2-ethanol, 6,6-dimethyl- (128-50-7)
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P272, P273, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 283 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Bicyclo[3.1.1]hept-2-ene-2-ethanol, 6,6-dimethyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Bicyclo3.1.1hept-2-ene-2-ethanol, 6,6-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryA moderate skin irritant; [RTECS] Safe when used as a flavoring agent in food; [JECFA] An irritant; [Acros Organics MSDS]
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- wgk
- WGK 3
- tsca
- TSCA listed
- risk_code
- 22
- Toxizität
- mouse,LD50,intramuscular,500mg/kg (500mg/kg),Journal of Scientific and Industrial Research, Section C: Biological Sciences. Vol. 21, Pg. 342, 1962.
- hazard_code
- Xn
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Acute Tox. 4 Oral
Chemie und Industrie
Pharmakologische Informationen
Cellular LocationsExtracellular
Verwendung und Herstellung
UsesPresent in carrot root oil; Used to make pesticides, soaps, detergents, and other household products; [Merck Index] Used as a flavoring agent; [FDA]
Use Classification
Fragrance Ingredients
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing InformationBicyclo[3.1.1]hept-2-ene-2-ethanol, 6,6-dimethyl-: ACTIVE
Anwendungen
OccurrenceReported found in carrots
VerwendenNopol is by and large confined to woody and piney fragrance types, in which it may be the chief ingredient or "carrier". But its own odor contribution is very limited, and the title material will ruin almost any floral note if the Nopol is used at higher levels of concentration.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter23 Anbieter
Hangzhou Collab Medicine Co.,Ltd.+86-15936229464 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
Xiamen AmoyChem Co., Ltd+86-86-5926051114 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
陕西晶和医药科技有限公司029-86062279 13324594253 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
常州安奈凯医药科技有限公司+86-0519-8359-8696 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
湖北摩科生物科技有限公司18274848843 · [email protected]
BOC Sciences[email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海旺珐化工科技有限公司（安徽珐诺伊医药科技有限公司）13918479294 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
湖北美索伦科技有限公司13419562052 13419562052 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
湖北摩科生物科技有限公司17320513646 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
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