1-Isopropyl-4-methylcyclohex-3-en-1-ol 4-萜烯醇

CAS 562-74-3 MFCD00001562

化学结构图

562-74-3
SMILES: CC1=CCC(O)(C(C)C)CC1

化学属性

Mol. FormulaC10H18O
Mol. Weight154.25
Density0.931
Refractive indexn20/D 1.478
Boiling Point88-90 °C at 760 mmHg
Flash Point79°C(lit.)
SolubilityVERY 略溶于水
Appearance 无色油状液体。呈暖的胡椒香、较淡的泥土香和陈腐的木材气息。沸点212℃或88～90℃(800Pa)。微溶于水，溶于醇类和油类。 天然品存在于肉豆蔻、小豆蔻，迷迭香、芜荽等中。
Melting Point137-188 °C

别名和识别编码

Chemical Name1-Isopropyl-4-methylcyclohex-3-en-1-ol
CAS Number562-74-3
Synonym Terpinen-4-ol {LY} Terpinen-4-ol {} {LY} Terpinen-4-ol {} {} {LY} Terpinen-4-ol {} {} {} {LY} Terpinen-4-ol {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Terpinen-4-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {}
EC Number209-235-5
Beilstein Registry Number1906603
MDL NumberMFCD00001562
PubChem Substance ID11230
Reaxys-RN1906603
Chemical Name Translation4-萜烯醇
Merck Number3935
LabNetwork Molecule IDLN01302000
Canonical SMILESCC1=CCC(C(C)C)(O)CC1
InChIInChI=1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3
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分类

  • {SNA} A - D, Alphabetical Listings, C-D, Certified Food Grade Products, Flavors and Fragrances, Halal Certified Products
  • {SNA} Alphabetical, Analytical Standards, Analytical/Chromatography, Chromatography, Lavandula, Life Sciences Standards, Myristica, Phyto Primary Pharmaceutical Reference Standards,
  • {SNA} Alphabetical Listings, C-D, Flavors and Fragrances, Halal Certified Products
  • {SNA} A-D, Alphabetical Listings, C-D, Certified Natural Products, Flavors and Fragrances, Kosher Certified Products
  • Pharmaceuticals
  • {uni_hamburg} no charge; carbocycle; alicycle; 6RingOnly; 6ring; alcohol; racemate; 1fragment
  • Intermediates & Fine Chemicals
  • {SNA} A-D,

产品应用

  • Shows antioxidant effects. Antiseptic.

相关文献及参考

  • [2]. Shapira S, et al. Terpinen-4-ol: A Novel and Promising Therapeutic Agent for Human Gastrointestinal Cancers. PLoS One. 2016 Jun 8;11(6):e0156540.
  • Beilstein: 06,00
  • Short: III/35C3
  • Short: III/35D4
  • Wong, S., et al.: Clin. Chem., 33, 214 (1987),
  • [1]. Hart PH, et al. Terpinen-4-ol, the main component of the essential oil of Melaleuca alternifolia (tea tree oil), suppresses inflammatory mediator production by activated human monocytes. Inflamm Res. 2000 Nov;49(11):619-26.
  • [1]. Hart PH, et al. Terpinen-4-ol, the main component of the essential oil of Melaleuca alternifolia (tea tree oil), suppresses inflammatory mediator production by activated human monocytes. Inflamm Res. 2000 Nov;49(11):619-26.
  • [2]. Shapira S, et al. Terpinen-4-ol: A Novel and Promising Therapeutic Agent for Human Gastrointestinal Cancers. PLoS One. 2016 Jun 8;11(6):e0156540.

安全信息

Signal word Warning
GHS Symbol
WGK Germany2
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P312
  • P301+P317
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P362+P364
  • P370+P378
  • P403 Store in a well-ventilated place. 储存在通风良好的地方。
  • P403+P233
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H227 Combustible liquid 可燃液体
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSOT0175110
Hazard Codes Xn 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1500 mg/kg
TOXIC EFFECTS :
   Kidney, Ureter, Bladder - urine volume increased
REFERENCE :
   CKFRAY Ceskoslovenska Farmacie.  (PNS-Ustredni Expedice a Dovoz Tisku,
   Kafkova 19, 160 00 Prague 6, Czechoslovakia)  V.1-    1952-
   Volume(issue)/page/year: 8,433,1959

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >2500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTOD7 Food and Chemical Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.20-    1982- Volume(issue)/page/year:
   20,833,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1016 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CCHCDE Zhonghua Jiehe He Huxixi Jibing Zazhi.  Chinese Journal of
   Tuberculosis and Respiratory Diseases.  (China International Book Trading
   Corp., POB 2820, Beijing, Peop. Rep. China) V.1-    1978-
   Volume(issue)/page/year: 4(4),203,1981

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 780 mg/kg
TOXIC EFFECTS :
   Kidney, Ureter, Bladder - urine volume increased
REFERENCE :
   CKFRAY Ceskoslovenska Farmacie.  (PNS-Ustredni Expedice a Dovoz Tisku,
   Kafkova 19, 160 00 Prague 6, Czechoslovakia)  V.1-    1952-
   Volume(issue)/page/year: 8,433,1959

TYPE OF TEST            : LD50 - Lethal

Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • MSDS 信息:4-Carvomenthenol(562-74-3).msds
  • TCI Shanghai:(+/-)-4-萜烯醇 (+/-)-Terpinen-4-ol,>;95.0%(GC)(562-74-3)
  • Sigma Aldrich:562-74-3(sigmaaldrich)
  • FEMA:2248
  • 图谱信息:4-萜烯醇(562-74-3)核磁图( 13 CNMR) 4-萜烯醇(562-74-3)红外图谱(IR1) 4-萜烯醇(562-74-3)质谱(MS) 4-萜烯醇(562-74-3)核磁图( 1 HNMR)
  • 用途一:食品用香料。主要用于配制香辛类香精。
  • Acros Organics:4-萜品醇 Terpinen-4-ol, 97%(562-74-3)
  • MOL 文件:562-74-3.mol
  • 4-萜烯醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T1993 (+/-)-萜烯-4-醇 (+/-)-Terpinen-4-ol 25ML 462元 2010/06/21 360020250 4-萜烯醇 Terpinen-4-ol 97% 25 GR 495元 2010/06/21 360021000 4-萜烯醇 Terpinen-4-ol 97% 100 GR 924元

系列性分类

  1. Life Science 生命科学
  2. Nutrition Research 营养研究
  3. Phytochemicals by Chemical Classification - Nutrition Research
  4. Plant Extracts - Phytochemicals by Chemical Classification
  1. Application Areas 应用领域分类
  2. Flavors and Fragrances 香精香料
  3. Kosher Certified Products - Flavors and Fragrances
  4. A-D - Kosher Certified Products
  1. Application Areas 应用领域分类
  2. Flavors and Fragrances 香精香料
  3. Alphabetical Listings - Flavors and Fragrances
  4. C-D - Alphabetical Listings
  1. Life Science 生命科学
  2. Biochemistry / Glyco-Chemistry
  3. Terpenes
  1. Medical Research Areas
  2. Metabolism
  3. Endogenous Metabolite  (内源性代谢物)

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