CAS 121-39-1 MFCD00005123-Ethyl 3-Phenylglycidate 3-苯基环氧乙烷甲酸乙酯 TAO{mole}

Ethyl 3-Phenylglycidate 3-苯基环氧乙烷甲酸乙酯

CAS 121-39-1 MFCD00005123

化学结构图

SMILES: CCOC(=O)C1OC1c1ccccc1

化学属性

Mol. Formula	C11H12O3
Mol. Weight	192
Density	1.102 g/mL at 25 °C(lit.)
Refractive index	1.5170 to 1.5210
Flash Point	>110°(230°F)
TSCA	Yes
Boiling Point	152°C/16mmHg(lit.)
Appearance	无色至微黄色液体，具有强烈的草莓似香味和草莓酱似滋味。沸点228℃。混溶于乙醇、乙醚、氯仿和非挥发性油，几不溶于水，不溶于丙二醇和甘油。

别名和识别编码

Chemical Name	Ethyl 3-Phenylglycidate
CAS Number	121-39-1
MDL Number	MFCD00005123
Synonym	GLYCIDIC ACID, 3-PHENYL:ETHYL ESTER 3-苯基-缩水甘油酸乙酯 3-苯基缩水甘油酸乙酯, CIS + TRANS, 90+% ethyl2,3-epoxy-3-phenylpropionate ethyl3-phenyloxiranecarboxylate ethyl3-phenyloxirane-2-carboxylate Ethyl 3-phenyloxiranecarboxylate ethyl3-phenylglycidate,mixtureofcisandtrans ethyl3-phenyloxirane ETHYL PHENYLGLYCIDATE Ethyl 3-phenylglycidate FEMA 2454 Ethyl 3-phenyloxirane-2-carboxylate 3-PHENYLGLYCIDIC ACID ETHYL ESTER 3-苯基缩水甘油酸乙酯,CIS +TRANS 3-苯基环氧乙烷甲酸乙酯, CIS + TRANS, 90+% ETHYL A B-EPOXYHYDROCINNAMATE Ethyl alpha,beta-epoxyhydrocinnamate 3-PHENYLOXIRANECARBOXYLIC ACID ETHYL ESTER Ethyl 3-phenyl-2-oxiranecarboxylate {Chemic
EC Number	204-467-3
PubChem Substance ID	8469
Reaxys-RN	163394
Beilstein Registry Number	18(5)6,373
Chemical Name Translation	3-苯基环氧乙烷甲酸乙酯
Wiswesser Line Notation	T3OTJ BOV2 CR
LabNetwork Molecule ID	LN01742275
InChI	InChI=1S/C11H12O3/c1-2-13-11(12)10-9(14-10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3

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

安全信息

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

Safety Statements

S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾；
S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
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；

Storage condition Moisture Sensitive 0-10 0-6°C 0-10°C

RTECSMB4970000

WGK Germany2

Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US)

Signal word

Hazard statements

H303 May be harmfully swallowed 吞食可能有害

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

Hazard Codes Xi

GHS Symbol

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2300 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: 13,101,1975

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 103 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 138,1,1984

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 103 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 138,1,1984

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 1 gm/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 89,269,1981

TYPE OF TEST            : Morphological transformation
TEST SYSTEM             : Rodent - mouse Fibroblast
DOSE/DURATION           : 103 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 138,1,1984

TYPE OF TEST            : Mutation in mammalian somatic cells
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 103 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 138,1,1984

其他信息

含量分析:按酯测定法(OT-18)中方法一进行。所取试样量为1.4g。计算中的当量因子(e)取96.11。
参考质量标准:FCC，1997 含量 ≥98.0% 折射率(n D 20 ) 1.514～1.521 相对密度(d 25 25 ) 1.120～1.125 醇中溶解度(OT-43) 1m1溶于6mL，70%乙醇，或1mL80%乙醇，仍透明酸值(OT-4) ≤3
上游原料:乙醇 --> 乙酸 --> 钠 --> 甲苯 --> 三乙胺 --> 苯甲醛 --> 甲酸乙酯 --> 氯乙酸乙酯 --> 丙酸 --> 碘乙烷 --> 蒽醌-2-磺酸钠
FEMA:2454
方法一:由苯甲醛和一氯乙酸乙酯在碱性缩聚剂存在下反应而得。在银盐催化下由苯环氧丙酸与碘乙烷反应而得。
MOL 文件:121-39-1.mol
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） 3-苯基缩水甘油酸乙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
Alfa Aesar:3-苯基环氧乙烷甲酸乙酯,cis+trans,90+% Ethyl 3-phenylglycidate, cis + trans, 90+%(121-39-1)
毒性:ADI尚未规定(FAO/WHO，1994)。 LD 50 2300mg/kg(大鼠，经口)。
Sigma Aldrich:121-39-1(sigmaaldrich)
使用限量:FEMA(mg/kg)：软饮料4.6；冷饮12；糖果18；焙烤食品20；布丁类10～70。适度为限(FDA§172．515，2000)。
敏感性:Moisture Sensitive
用途一:GB 2760—1996允许使用的食用香料。主要用于配制草莓，樱桃之类浆果型香精。
Acros Organics:Ethyl 3-phenylglycidate, mixture of cis and trans, 90%(121-39-1)