CAS 106-22-9 MFCD00002935-Citronellol β-香茅醇 TAO{mole}

Citronellol β-香茅醇

CAS 106-22-9 MFCD00002935

化学结构图

SMILES: CC(C)=CCCC(C)CCO

化学属性

Mol. Formula	C10H20O
Mol. Weight	156.27
Density	0.855
Refractive index	1.4530 to 1.4590
Vapor Density	5.4 (vs air)
Boiling Point	224.5±0.0 °C at 760 mmHg
Vapor Pressure	~0.02 mmHg ( 25 °C)
Melting Point	77-83°C
Flash Point	98.3±0.0 °C
TSCA	Yes
Solubility	略溶于水
Appearance	无色透明液体。右旋香茅醇沸点244.4℃，相对密度0.8590（20/4℃）、左旋香茅醇沸点108-109℃（1.33kPa），相对密度0.859（18/4℃）。易溶于醇、醚、几乎不溶于水。具有玫瑰甜香。左旋香茅醇的香气比右旋香茅醇的幽雅。天然精油含有右旋或左旋香茅醇及其消旋体。右旋香茅醇主要存在于芸香油、香茅油和柠檬桉油中，左旋香茅醇主要有存在于玫瑰油和天竺葵属植物的精油中。

别名和识别编码

Chemical Name	Citronellol
MDL Number	MFCD00002935
CAS Number	106-22-9
EC Number	203-375-0
Beilstein Registry Number	1721507
Synonym	Citronellol {LY} Citronellol {} {LY} Citronellol {} {} {LY} Citronellol {} {} {} {LY} Citronellol {} {} {} {} {LY} Citronellol {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Citronellol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID	87565502
Merck Number	2330
Reaxys-RN	1721507
Chemical Name Translation	β-香茅醇
Wiswesser Line Notation	Q2Y1&3UY1&1
LabNetwork Molecule ID	LN00193785
InChI	InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3
Canonical SMILES	CC(CCC=C(C)C)CCO

信息真实价格透明资金保障专业采购外包团队在线服务

品牌质保精细包装现货库存一流品牌服务

产品应用

一种在香水和驱虫剂中使用的植物化学物质。

安全信息

Signal word Warning

GHS Symbol

WGK Germany1

Safety Statements

S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；

Risk Statements

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

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。
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。
P302+P352
P302+P352+P332+P313+P362+P364
P305+P351+P338
P305+P351+P338+P337+P313
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。
P332+P313
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

Hazard statements

H303+H313
H315 Causes skin irritation 会刺激皮肤
H317 May cause an allergic skin reaction 可能导致皮肤过敏
H319 Causes serious eye irritation 严重刺激眼睛

Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

RTECSRH3400000

Packing GroupIII

UN Number UN3082

Hazard Codes Xi,N Xi

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 2650 mg/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: 13,757,1975

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3450 mg/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: 13,757,1975

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 4 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JSICAZ Journal of Scientific and Industrial Research, Section C: Biological
   Sciences.  (New Delhi, India)  V.14-21, 1955-62.  For publisher information,
   see IJEBA6.  Volume(issue)/page/year: 21,342,1962

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 880 mg/kg
TOXIC EFFECTS :
   Peripheral Nerve and Sensation - spastic paralysis with or without sensory
   change
REFERENCE :
   SIZSAR Sapporo Igaku Zasshi.  Sapporo Medical Journal.  (Sapporo Igaku
   Daigaku, Nishi-17-chome, Minami-1-jo, Chuo-ku, Sapporo 060, Japan)  V.3-
   1952-  Volume(issue)/page/year: 3,73,1952

其他信息

用途二:用于提制香叶醇或香茅醛，也用作杀虫剂、驱蚊药和皂用香精
用途五:香茅醇是最常用的香料，最适用于玫瑰香，也可作柑桔香的香精和许多香茅醇酯类的原料，并可用于制造羟基二氢香茅醇并进而制造羟基二氢香茅醛。香茅醇是调配各种玫瑰系花香香精不可缺少的原料，几乎可应用在一切化妆品中。作为食用香料，按日本《
Hazard Note:Irritant
微溶于水。
蒸气压:~0.02 mm Hg ( 25 °C)
MOL 文件:106-22-9.mol
用途五:香茅醇是最常用的香料，最适用于玫瑰香，也可作柑桔香的香精和许多香茅醇酯类的原料，并可用于制造羟基二氢香茅醇并进而制造羟基二氢香茅醛。香茅醇是调配各种玫瑰系花香香精不可缺少的原料，几乎可应用在一切化妆品中。作为食用香料，按日本《食品添加物公定书》的规定，要求纯度在94%以上，不得用于加香以外的目的。
Alfa Aesar:香茅醇,96% Citronellol, 95%(106-22-9)
使用限量:FEMA(mg/kg)：软饮料4.1；冷饮4.1；糖果16；焙烤食品18；布丁类5.8；胶姆糖29～52。适度为限(FDA§172．515，2000)。
图谱信息:香茅醇(106-22-9)核磁图( 1 HNMR) 香茅醇(106-22-9)红外图谱(IR1) 香茅醇(106-22-9)质谱(MS) 香茅醇(106-22-9)Raman光谱
参考质量标准:指标名称@FAO/WHO.1979@FCC,1996 含量(总醇量)@-@≥90.0% 旋光度@-5°～+5°@- 折射率n D 20 @1.452～l.462@1.454～1.462 相对密度 (d 20 20 )0.853～0.863l(d 25 25 )@0.850～0.860 醇中溶解度(OT-43)@lml溶于2ml70%乙醇@lml溶于2mI。70%乙醇，稀释至10ml不变酸值(OT-4)@≤1.0@- 醛(香茅醛计)@-@＜1.0% 酯含量(乙酸香茅酯计)@-@＜1.0%
Acros Organics:香茅醇 Citronellol, 95%(106-22-9)
毒性:Adl 0～0.5mg/kg(FAO/WHO，1994)。 LD 50 3450mg/kg(大鼠，经口)。
下游产品:香叶醇 --> 香茅醛 --> 3,7-二甲基-6-辛酸 --> 玫瑰油 --> 3,7-二甲基-7-辛烯醇 --> 乙酸香茅酯 --> (2-甲基)3,7-二甲基-6-辛烯丙酸酯 --> 3，7-二甲基-1-辛醇
上游原料:乙醇 --> 氢 --> 叔丁醇 --> 硫酸亚铁 --> 柠檬醛 --> 香叶醇 --> 香茅醛 --> 橙花醇 --> 蒎烯 --> 二异丁基氢化铝 --> 桉叶油 --> 香茅油 --> 三异丁基铝 --> 铂黑 --> 二氢月桂烯 --> 右旋香茅醇 --> 顺蒎烷
香茅醇价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 C0370 β-香茅醇 beta-Citronellol 25ML 130元 2014/06/02 C0370 β-香茅醇 beta-Citronellol 500ML 837元 2010/06/21 110465000 香茅醇 Citronellol 95% 500 ML 822元
TCI Shanghai:β-香茅醇 beta-Citronellol,>;92.0%(GC)(106-22-9)
{Che
{Chemicalbook
Sigma Aldrich:106-22-9(sigmaaldrich)
下游产品:香叶醇 -
上游原料:乙醇 --> 氢 --> 叔丁醇 --> 硫酸亚铁 --> 柠檬醛 --> 香叶醇 --> 香茅醛 --> 橙花醇 --> 蒎烯 --> 二异丁基氢化
方法二:（1）右旋和消旋香茅醇由精油中的香茅醛部分制造。从爪哇香草油蒸馏得到的右旋香茅醛，以兰尼镍催化剂接触氢化，转变为右旋香茅醇。