CAS 105-50-0 MFCD00009200-Diethyl 1,3-acetonedicarboxylate 1,3-丙酮二羧酸二乙酯 -LabNovo

Diethyl 1,3-acetonedicarboxylate 1,3-丙酮二羧酸二乙酯

CAS 105-50-0 MFCD00009200

化学结构图

SMILES: CCOC(=O)CC(=O)CC(=O)OCC

化学属性

Mol. Formula	C9H14O5
Mol. Weight	202.21
Density	1.113
Boiling Point	250°C at 760 mmHg
Refractive index	1.4380 to 1.4420
Flash Point	71°C(lit.)
TSCA	Yes
Solubility	10 G/L (20 ºC)
Stability	易吸潮
Melting Point	125 °C

别名和识别编码

Chemical Name	Diethyl 1,3-acetonedicarboxylate
CAS Number	105-50-0
EC Number	203-302-2
Beilstein Registry Number	640146
MDL Number	MFCD00009200
Synonym	Diethyl 3-oxopentanedioate {LY} Diethyl 3-oxopentanedioate {} {LY} Diethyl 3-oxopentanedioate {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Diethyl 3-oxopentanedioate
PubChem Substance ID	66045
Chemical Name Translation	1,3-丙酮二羧酸二乙酯
Reaxys-RN	640146
InChIKey	ZSANYRMTSBBUCA-UHFFFAOYSA-N
LabNetwork Molecule ID	LN00237104
InChI	InChI=1S/C9H14O5/c1-3-13-8(11)5-7(10)6-9(12)14-4-2/h3-6H2,1-2H3
Canonical SMILES	O=C(OCC)CC(CC(OCC)=O)=O

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

有机合成中间体。

安全信息

Signal word Warning

GHS Symbol

WGK Germany3

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；

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

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。
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
P304+P340
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
P302+P352
P501 Dispose of contents/container to..… 处理内容物/容器.....
P337+P313
P405 Store locked up. 上锁保管。
P305+P351+P338
P332+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。
P403+P233
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
P403+P235

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

UN Number UN 2810 2810

Hazard Codes F

Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°

Hazard statements

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
H227 Combustible liquid 可燃液体

其他信息

用途一:用于有机合成
1,3-丙酮二羧酸二乙酯价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 A0055 1,3-丙酮二甲酸二乙酯 Diethyl 1,3-Acetonedicarboxylate 500ML 2890元 2014/06/02 A0055 1,3-丙酮二甲酸二乙酯 Diethyl 1,3-Acetonedicarboxylate 25ML 344元 2010/06/21 325632500 1,3-丙酮二羧酸二乙酯 Diethyl 1,3-acetonedicarboxylate 95% 250 ML 2098元
上游原料:1,3-丙酮二羧酸
Hazard Note:Flammable/Moisture Sensitive
图谱信息:1,3-丙酮二羧酸二乙酯(105-50-0)质谱(MS) 1,3-丙酮二羧酸二乙酯(105-50-0)红外图谱(IR1) 1,3-丙酮二羧酸二乙酯(105-50-0)核磁图( 13 CNMR) 1,3-丙酮二羧酸二乙酯(105-50-0)核磁图( 1 HNMR)
1,3-丙酮二羧酸二乙酯价格(试剂级):更新日期产品编号产品名称包装价格 2011/04/16 A0055 1,3-丙酮二甲酸二乙酯 Diethyl 1,3-Acetonedicarboxylate 500ML 3600元 2011/04/16 A0055 1,3-丙酮二甲酸二乙酯 Diethyl 1,3-Acetonedicarboxylate 25ML 466元 2010/06/21 325632500 1,3-丙酮二羧酸二乙酯 Diethyl 1,3-acetonedicarboxylate 95% 250 ML 2098元
水中溶解度: 10 g/l 水 (20°C)
海关编码:29183000
MOL 文件:105-50-0.mol
用途三:雷尼酸锶中间体
Sigma Aldrich:105-50-0(sigmaaldrich)
方法一:由1,3-丙酮二羧酸与无水乙醇反应得到。
TCI Shanghai:1,3-丙酮二甲酸二乙酯 Diethyl 1,3-Acetonedicarboxylate,>;95.0%(GC)(105-50-0)
下游产品:6-氯-4-乙氧基烟酸 --> 4-乙氧基-6-氯吡啶-3-甲酸乙酯 --> 4,6-二氯烟酸乙酯 --> 4,6-二氯烟酸 --> 4,6-二羟基烟酸乙酯 --> 尿嘧啶-4-乙酸
用途二:有机合成中间体。
MSDS 信息:Diethyl 1,3-acetonedicarboxylate(105-50-0).msds
敏感性:Moisture Sensitive
检测方法:GC,NMR
Acros Organics:1,3-丙酮二羧酸二乙酯 Diethyl 1,3-acetonedicarboxylate, 95%(105-50-0)
外观:无色油状液体
Alfa Aesar:丙酮二甲酸二乙酯,96% Diethyl acetone-1,3-dicarboxylate, 96%(105-50-0)