Myrcene 月桂烯

CAS 123-35-3 MFCD00008908

化学结构图

123-35-3
SMILES: C=CC(=C)CCC=C(C)C

化学属性

Mol. FormulaC10H16
Mol. Weight136.23
Density0.791 g/mL at 25 °C(lit.)
Vapor Density4.7 (vs air)
Refractive index1.4690 to 1.4730
Boiling Point167°C at 760 mmHg
Vapor Pressure~7 mmHg ( 20 °C)
Flash Point39.44°C
TSCAYes
Solubility难溶
Appearance 无色至淡黄色油状液体。具有甜橘味和香脂气。沸点167℃。闪点37.2℃。溶于乙醇、乙醚、氯仿、冰醋酸和大多数非挥发性油,不溶于水。 天然品存在于月桂叶油、酒花油和马鞭草油等中。
Stability对热和空气敏感
Melting Point<-10 °C

别名和识别编码

Chemical NameMyrcene
CAS Number123-35-3
Synonym Myrcene {LY} Myrcene {} {LY} Myrcene {} {} {LY} Myrcene {} {} {} {LY} Myrcene {} {} {} {} {LY} Myrcene {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Myrcene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number204-622-5
Beilstein Registry Number1,264
MDL NumberMFCD00008908
PubChem Substance ID87572325
Merck Number6331
Reaxys-RN1719990
Chemical Name Translation月桂烯
Wiswesser Line Notation1Y1&U3YU1&1U1
LabNetwork Molecule IDLN00194036
Canonical SMILESC=CC(CC/C=C(C)/C)=C
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分类

  • {SNA} Acyclic, Alcoholic & Nonalcoholic Beverages, Alkenes, All Alphabetically Sorted, Alphabetical, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Artemisia vulgaris, Aspalathus linearis (Rooibos tea), Beer, Boswellia carterii, Building Blocks, Cell Biology, Chamaemelum nobile (Chamomile tea), Chemical Class, Chemical Synthesis, Chromatography, Citrus, Citrus aurantium (Seville orange), Elet
  • {SNA} Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks

产品应用

  • 烃类合成香料。主要用于古龙香水和消臭剂。也是合成萜烯类合成香料的重要原料。

相关文献及参考

  • Merck: 14,6331
  • Short: IV/20A
  • Short: III/38B
  • Short: IV/6
  • Merck: 14,6331 Beilstein:1,264
  • Short: IV/8C
  • Appendino, G., et al.: J. Agric. Food Chem., 51, 6970 (2003),

安全信息

Signal word Danger Warning
GHS Symbol
WGK Germany1
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
  • S62 If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label where possible 吞食后不要催吐:立即求医并出示该容器或标签;
  • 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
  • R10 Flammable 易燃
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R38 Irritating to skin 刺激皮肤
  • R65 Harmful: may cause lung damage if swallowed 若吞咽可能伤害肺部器官
Precautionary statements
  • 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
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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
  • 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。
  • P332+P313
  • P337+P313
  • P308+P313
  • P302+P352+P332+P313+P362+P364
  • P301+P310
  • P331 Do NOT induce vomiting.. 不要催吐。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P303+P361+P353
  • P201 Obtain special instructions before use. 使用前获取专门指示。
RTECSRG5365000
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • 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
  • H304 May be fatal if swallowed and enters airways 吞食和进入呼吸道可能致命
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Packing GroupIII
UN Number 3295 UN3295 2319 UN 2319 3/PG 3
Hazard Codes Xn Xi
Storage condition -20°C, stored under nitrogen {LY} -20°C, stored under nitrogen 0-10 0-10°C 2-8°C {} {LY} -20°C, stored under nitrogen {} {} {LY} -20°C, stored under nitrogen {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitro
Hazard Class3
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 14,615,1976

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 12 gm/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - pre-implantation mortality (e.g. reduction in
   number of implants per female; total number of implants per corpora lutea)
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   FCTOD7 Food and Chemical Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.20-    1982- Volume(issue)/page/year:
   31,31,1993

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 14 mg/kg
SEX/DURATION            : female 15-21 day(s) after conception
                          lactating female 21 day(s) post-birth
TOXIC EFFECTS :
   Reproductive - Effects on Newborn - weaning or lactation index (e.g., #
   alive at weaning per # alive at day 4)
REFERENCE :
   FCTOD7 Food and Chemical Toxicology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.20-    1982- Volume(issue)/page/year:
   31,623,1993

其他信息

  • 用途二:GB 2760--1996规定为允许使用的食用香料。主要用以配制什锦水果和柑橘类香精。
  • 食品添加剂最大允许使用量最大允许残留量标准:添加剂中文名称 允许使用该种添加剂的食品中文名称 添加剂功能 最大允许使用量(g/kg) 最大允许残留量(g/kg) 月桂烯 食品 食品用香料 用于配制香精的各香料成分不得超过在GB 2760中的最大允许使用量和最大允许残留量
  • 含量分析:按GT-10-4中用极性柱进行气相色谱法分析。
  • 使用限量:FEMA(mg/kg):软饮料4.4;冷饮6.4;糖果0.50413;焙烤食品4.9。 适度为限(FDA§172.515,2000)。
  • 方法一:由芳樟醇为原料制备而得。 由β-蒎烯在160℃下裂解而成。 由含量达30%~35%的酒花油分离而得。
  • 月桂烯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0235 月桂烯(含稳定剂BHT) Myrcene (stabilized with BHT) 500ML 785元 2014/06/02 M0235 月桂烯(含稳定剂BHT) Myrcene (stabilized with BHT) 25ML 150元 2010/06/21 128085000 月桂烯 Myrcene 90%, tech., stabilized 500 ML 501元
  • TCI Shanghai:月桂烯 Myrcene (stabilized with BHT),>;70.0%(GC)(123-35-3)
  • 用途三:烃类合成香料。主要用于古龙香水和消臭剂。也是合成萜烯类合成香料的重要原料。
  • 蒸气密度:4.7 (vs air)
  • 下游产品:芳樟醇 --> 香叶醇
  • 毒性:GRAS(FEMA)。
  • 图谱信息:月桂烯(123-35-3)质谱(MS) 月桂烯(123-35-3)核磁图( 13 CNMR) 月桂烯(123-35-3)红外图谱(IR1)
  • MOL 文件:123-35-3.mol
  • Acros Organics:香叶烯/月桂烯 Myrcene, tech., stabilized, 90%(123-35-3)
  • FEMA:2762
  • 月桂烯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 M0235 月桂烯(含稳定剂BHT) Myrcene (stabilized with BHT) 500ML 756元 2011/04/16 M0235 月桂烯(含稳定剂BHT) Myrcene (stabilized with BHT) 25ML 167元 2010/06/21 128085000 月桂烯 Myrcene 90%, tech., stabilized 500 ML 501元
  • 蒸气压:~7 mm Hg ( 20 °C)
  • 不溶于水。溶于乙醇、乙醚、氯仿。能与大多数其它香料混合。具有令人愉快的甜香脂气味。
  • 参考质量标准:FCC,1996 含量 ≥90.0% 折射率(n D 20 ) 1.466~1.471 相对密度(d^ 25 25 ) 0.789~0.793 过氧化值 ≤50.0
  • 上游原料:芳樟醇 --> 蒎烯 --> 酒花油
  • F:10-23
  • 用途一:用于合成香料
  • Alfa Aesar:Myrcene, tech. 90%(123-35-3)
  • Sigma Aldrich:123-35-3(sigmaaldrich)

系列性分类


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