(+)-Neomenthol (+)-新薄荷醇

CAS 2216-52-6 MFCD00062980

化学结构图

2216-52-6
SMILES: CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1O

化学属性

Mol. FormulaC10H20O
Mol. Weight156.27
Refractive index1.4590 to 1.4620
Boiling Point212°C(lit.)
Vapor Pressure0.8 mmHg ( 20 °C)
Density0.899 g/mL at 25 °C(lit.)
Melting Point-22 °C(lit.)
Flash Point82°C(lit.)

别名和识别编码

Chemical Name(+)-Neomenthol
Synonym {uni_hamburg} (+)-Neomenthol, (1S,2S,5R)-2-Isopropyl-5-methylcyclohexanol, [1S-(1β,2β,5α)]-5-Methyl-2-(1-methylethyl)cyclohexanol 1S-(1BETA,2BETA,5ALPHA)-5-METHYL-2-(1-METHYLETHYL)CYCLOHEXANOL (+)-NEOMENTHOL NEOMENTHOL, (+)- Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1S,2S,5R)- (+) neomenthol FEMA 2666 (1S,2S,5R)-(+)-2-Isopropyl-5-methylcyclohexanol (1S,2S,5R)-2-Isopropyl-5-methyl-1-cyclohexanol (1S,2S,5R)-(+)-新薄荷醇 新薄荷腦 5-methyl-2-(1-methylethyl)-,[1S-(1.alpha.,2.alpha.,5.beta.)]-Cyclohexanol 新【草(之上)+孟】醇 2-Isopropyl-5-methylcyclohexanol-[1S-(1a,2a,5b)]- (1R, 3S, 4S)-4-MENTHAN-3-OL [1S-(1α,2α,5β)]-5-甲基-2-(1-甲基乙基)环己醇 (1R)-(+)-neomenthol D-neomenthol Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1α,2α,5β)]- (1S,2S,5R)-(+)-NEOMENTHOL D-NEOMENTHOL (+)-NEOMENTHOL 96+% (1R,3S,4S)-p-Menthane-3-ol D-NEOMENTHOL 99+% (1R,3S,4S)-P-MENTHAN-3-OL (1S)-2α-Isopropyl-5β-methylcyclohexan-1α-ol 5-methyl-2-(1-methylethyl)-,[1s-(1alpha,2alpha,5beta)]-cyclohexano (+)-新孟醇/新薄荷醇 (1S,2S,5R)-(+)-Neomenthol (+)-NEOMENTHOL WITH GC (1S,2S,5R)-Neomenthol (1S,2S,5R)-2-ISOPROPYL-5-METHYLCYCLOHEXANOL (+)-新薄荷醇 (1S,2S,5R)-2-异丙基-5-甲基环己醇 D-新薄荷醇 [1S-(1β,2β,5α)]-5-甲基-2-(1-甲基乙基)环己醇 (+)-新薄荷醇 5β-Methyl-2α-(1-methylethyl)cyclohexan-1α-ol
MDL NumberMFCD00062980
CAS Number2216-52-6
PubChem Substance ID439263
EC Number218-691-4
Beilstein Registry Number6(4)149
Chemical Name Translation(+)-新薄荷醇
Reaxys-RN2037488
InChIInChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9+,10+/m1/s1
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分类

  • {Chemicalbook} 食品添加剂: 食用香料(增香剂): 天然等同香料和人造香
  • {SNA} Alcohols, Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Organic Building Blocks
  • {SNA} Alphabetical Listings, Flavors and Fragrances, I-N, Kosher Certified Products, M-N
  • {uni_hamburg} no charge; carbocycle; alicycle; 6RingOnly; 6ring; alcohol; chiral; 1fragment

相关文献及参考

  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H227 Combustible liquid 可燃液体
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSOT0450000
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • P332+P313
  • P370+P378
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P302+P350
  • P337+P313
  • P302+P352+P332+P313+P362+P364
Signal word Danger
Hazard Codes Xi
Risk Statements
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
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;

其他信息

  • MOL 文件:2216-52-6.mol
  • FEMA:2666
  • 蒸气压:0.8 mm Hg ( 20 °C)
  • 图谱信息:[1S-(1α,2α,5β)]-5-甲基-2-(1-甲基乙基)环己醇 (2216-52-6)质谱(MS) [1S-(1α,2α,5β)]-5-甲基-2-(1-甲基乙基)环己醇 (2216-52-6)核磁图( 13 CNMR) [1S-(1α,2α,5β)]-5-甲基-2-(1-甲基乙基)环己醇 (2216-52-6)红外图谱(IR1) [1S-(1α,2α,5β)]-5-甲基-2-(1-甲基乙基)环己醇 (2216-52-6)核磁图( 1 HNMR)
  • 参考质量标准:FAO/WHO,2001 折射率(n D 20 ) 1.459~1.460 相对密度d 20 20 0.896~0.903 熔点 -22℃ 旋光度[α] D 20 20° 含量(GT-10-4) ≥99%
  • Sigma Aldrich:2216-52-6(sigmaaldrich)
  • 使用限量:FEMA(mg/kg):软饮料10.0;冷饮31.0;糖果50.0;焙烤制品48.0。 FDA(§172.515,2000):适度为限。
  • TCI Shanghai:(+)-新薄荷醇 (+)-Neomenthol,>;96.0%(GC)(2216-52-6)
  • 毒性:GRAS(FEMA)。

系列性分类


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