CAS 123-35-3 MFCD00008908-Myrcene 月桂烯 TAO{mole}

Myrcene 月桂烯

CAS 123-35-3 MFCD00008908

化学结构图

SMILES: C=CC(=C)CCC=C(C)C

化学属性

Mol. Formula	C10H16
Mol. Weight	136.23
Density	0.791 g/mL at 25 °C(lit.)
Vapor Density	4.7 (vs air)
Refractive index	1.4690 to 1.4730
Boiling Point	167°C at 760 mmHg
Vapor Pressure	~7 mmHg ( 20 °C)
Flash Point	39.44°C
TSCA	Yes
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 Name	Myrcene
CAS Number	123-35-3
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 Number	204-622-5
Beilstein Registry Number	1,264
MDL Number	MFCD00008908
PubChem Substance ID	87572325
Merck Number	6331
Reaxys-RN	1719990
Chemical Name Translation	月桂烯
Wiswesser Line Notation	1Y1&U3YU1&1U1
LabNetwork Molecule ID	LN00194036
Canonical SMILES	C=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。

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)