CAS 80-26-2 MFCD00037155-Terpinyl Acetate (mixture of isomers) 乙酸松油酯 (异构体混合物) TAO{mole}

Terpinyl Acetate (mixture of isomers) 乙酸松油酯 (异构体混合物)

CAS 80-26-2 MFCD00037155

化学结构图

SMILES: CC1CCC(CC=1)C(C)(C)OC(C)=O

化学属性

Mol. Formula	C12H20O2
Mol. Weight	196.29 g/mol
Refractive index	n20/D 1.465(lit.)
Boiling Point	220
Density	0.953
Flash Point	115°C(lit.)
TSCA	Yes
Appearance	无色液体，具有木香花香味。不溶于水，易溶于乙醇、苯等有机溶剂。

别名和识别编码

Chemical Name	Terpinyl Acetate (mixture of isomers)
Synonym	(±)-2-(4-甲基-3-环己烯基)乙酸异丙酯 (±)-α-乙酸松油酯 ()--Terpinyl acetate (±)-α-Terpinyl acetate 1-Methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl acetate 3-CYCLOHEXENE-1-METHANOL, ALPHA, ALPHA, 4-TRIMETHYL:ACETATE 4-Terpinyl acetate A-乙酸松油酯,TECH.90% ACETIC ACID TERPINYL ESTER Alpha-Terpenyl acetate P-MENTH-1-ENE-8-YL ACETATE Terpinyl Acetate (mixture of isomers) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
MDL Number	MFCD00037155
CAS Number	80-26-2
PubChem Substance ID	87576047
EC Number	201-265-7
Beilstein Registry Number	3198769
Reaxys-RN	3198769
Chemical Name Translation	乙酸松油酯 (异构体混合物)
Wiswesser Line Notation	L6UTJ A DXOV1
LabNetwork Molecule ID	LN00197679

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分类

{SNA} Alphabetical Listings,
{SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, Halal Certified Products, Kosher Certified Products, O - Z, O-Z, Q-Z,
{SNA} Boswellia carterii, Building Blocks, C12 to C63, Carbonyl Compounds, Chemical Synthesis, Citrus aurantium (Seville orange), Elettaria Cardamomum (Cardamom), Esters, Hypericum perforatum (St John's wort), Lavandula angustifolia (Lavendar tea), Melaleuca alternifolia, Nutrition Research, Ocimum basilicum (Basil), Organic Building Blocks, Phytochemicals by Plant (Food/Spice/Herb), 细胞生物学
{SNA} Alphabetica

安全信息

GHS Symbol

WGK Germany2

Hazard statements

H315 Causes skin irritation 会刺激皮肤
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

RTECSOT0200000

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。
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
P332+P313
P305+P351+P338+P337+P313
P302+P350
P337+P313
P302+P352+P332+P313+P362+P364

Signal word

Risk Statements

R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

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；
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；
S36 Wear suitable protective clothing 穿戴适当的防护服；

Hazard Codes Xi

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 5075 mg/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Olfaction) - effect, not otherwise
   specified
   Sense Organs and Special Senses (Eye) - effect, not otherwise specified
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 2,327,1964

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : >1 gm/m3
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 58(10),27,1993

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 4800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 58(10),27,1993

其他信息

所属类别二:食品添加剂: 食用香料（增香剂）: 天然等同香料和人造香
乙酸松油酯价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 T0023 乙酸萜品酯 Terpinyl Acetate 500ML 688元 2014/06/02 T0023 乙酸萜品酯 Terpinyl Acetate 25ML 137元 2010
TCI Shanghai:乙酸萜品酯 Terpinyl Acetate,>;80.0%(GC)(80-26-2)
MSDS 信息:Terpinyl acetate(80-26-2).msds
MOL 文件:80-26-2.mol
用途三:是配制香柠檬油、薰衣草油、橙叶油等香料之一。由于价格较低，常用于薰衣草、古龙、香薇、松针、辛香、柑橘香等型香精中，可用于皂用香精。也可用于食用香精，如浆果、白柠檬、橙子、樱桃、桃子、梅子、杏子、辛香、肉香等。亦用于小豆蔻、百里香及其他调味精油中以增强辛香香味。
方法二:在室温下，在松节油中加入由醋酸、硫酸和水的混合液，混合时保持45～50℃，然后在30～40℃下放置数小时，加水使油层析出，分离后用碳酸钠液中和，再经减压蒸馏除杂而得。由松油醇和醋酐、无水醋酸钠反应而得。
含量分析:按酯测定法(OT-18)中方法一测定。所取试样量为1g。回流时间改为4h。计算中的当量因子(e)取98.15。或按气相色谱法(GT-10-4)中用非极性柱方法测定。按FCC规定测得值为两种异构体之和。
使用限量:FEMA(mg/kg)：软饮料3.5；冷饮3.2；糖果6.3；焙烤食品15；胶姆糖14～260；调味品15；肉类1.7～40。适度为限(FDA§172．515，2000)。
毒性:GRAS(FEMA)。 LD 50 4160mg/kg(大鼠，经口)。
参考质量标准一:QB 1029—91 指标名称规格 97% 95% 90% 色状无色至微黄色透明液体，小于4号色标香气类似香柠檬和薰衣草香气含量/% ≥97.0 ≥95.0 ≥90.0 旋光度(25℃) -9°～+9° -9°～+9° - 折射率(n D 20 ) 1.4640～1.470 1.4640～1.4700 1.4640～1.4700 相对
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）乙酸松油酯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
参考质量标准二:QB 1029--1991 97% 95% 90% 色状无色至微黄色透明液体，色泽小于4号色标香气类似香柠檬和薰衣草香气相对密度d 25 25 0.953~0.962 0.952~0.962 0.947~0.960 折射率n D 20 1.464～1.467 1.464～1.470 1.464～1.470 旋光度(25℃) -9°～+9° -9°～+9° 一溶解度(25℃) 1：5，70%乙醇 1：8，70%乙醇一含量/% ≥97.0 ≥95.0 ≥90.0 酸值 ≤1.0 ≤1.0 ≤1.0
方法一:由松油醇与醋酐和无水醋酸钠反应，反应物用碱中和，再用水洗涤，分离干燥后减压蒸馏得成品。以松节油为原料：在松节油中加入硫酸、醋酸的混合水溶液，混合时保持温度45~50℃，然后在30~40℃下放置数小时。再加入水，使油层析出，分离后用碳酸钠溶液中和，再经减压蒸馏而得产品。
Sigma Aldrich:80-26-2(sigmaaldrich)
所属类别一:食品添加剂: 食品香料
用途一:用于调配熏衣草、古龙香水、香皂及食用香精等
上游原料:乙酐 --> 无水醋酸钠 --> 松节油 --> alpha-松油醇 --> 松油
Alfa Aesar:a-乙酸松油酯,tech.90% alpha-Terpinyl acetate, tech. 90%(80-26-2)