기본 정보
- CAS
128-50-7- 표준 SMILES
CC1(C)C2CC=C(CCO)C1C2- InChIKey
ROKSAUSPJGWCSM-UHFFFAOYSA-N- 분자식
- C11H18O
- 평균 분자량
- 166.26 g/mol
- 단동위원소 질량
- 166.1357652
개요
nopol has been reported in Daucus carota with data available.
이름 및 식별자
- 우선 이름
- Nopol
- IUPAC
- 2-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)ethanol
- 현지명
- 노폴
- 영어명
- NOPOL
- 분자식
- C11H18O
- 분자량
- 166.26
이름 및 동의어
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
이름 더 보기
노폴HomomyrtenolNOPOL 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-
데이터베이스 식별자
- CAS
128-50-7、35836-73-8- PubChem CID
- 31408
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 215
실험 및 물리화학적 성질
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
물리화학적 성질
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
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.
유해성 정보
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%)
안전 데이터
- wgk
- WGK 3
- tsca
- TSCA listed
- 독성
- mouse,LD50,intramuscular,500mg/kg (500mg/kg),Journal of Scientific and Industrial Research, Section C: Biological Sciences. Vol. 21, Pg. 342, 1962.
- risk_code
- 22
- hazard_code
- Xn
- 기존화학 물질
- KE-11230
- Hazard Classifications
- Acute Tox. 4 Oral
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
약리 정보
Cellular LocationsExtracellular
용도 및 제조
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
응용 분야
출처Reported found in carrots
용도Nopol 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.
상·하류 제품 정보
상류 원료
하류 제품
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