Glutaric Acid 戊二酸

CAS 110-94-1 MFCD00004410

化学结构图

110-94-1
SMILES: O=C(O)CCCC(=O)O

化学属性

Mol. FormulaC5H8O4
Mol. Weight132.12
Density1.316
TSCAYes
Boiling Point302.9°C at 760 mmHg
Melting Point95-98°C
Solubility易溶于无水乙醇，溶于苯、氯仿、醇、醚。
Flash Point200°C/20mm

别名和识别编码

Chemical NameGlutaric Acid
CAS Number110-94-1
EC Number203-817-2
Beilstein Registry Number1209725
MDL NumberMFCD00004410
Synonym Glutaric acid {LY} Glutaric acid {} {LY} Glutaric acid {} {} {LY} Glutaric acid {} {} {} {LY} Glutaric acid {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Glutaric acid {} {} {} {} {} {} {} {} {} {} {}
Merck Number4473
PubChem Substance ID743
Reaxys-RN1209725
Chemical Name Translation戊二酸
Wiswesser Line NotationQV3VQ
LabNetwork Molecule IDLN00193417
InChIInChI=1S/C5H8O4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)
Canonical SMILESO=C(O)CCCC(O)=O
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分类

  • {SNA} Building Blocks, C1 to C5, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {SNA} Acid, Acids and Esters, All Alphabetically Sorted, Analytical Standards, Analytical/Chromatography, CRM for chromatography, Certified Reference Materials (CRMs), Chromatography, Flavors and Fragrances, Food & Beverage Standards, Food Products & Beverages, Fruits, G-L, Grape, Natural Products, Organic Acids, Organic CRMs Alphabetical, Organic CRMs TraceCERT, Substance Classification
  • {SNA} Acid,
  • {SNA} A-L,

相关文献及参考

  • [2]. Boy N, et, al. Proposed recommendations for diagnosing and managing individuals with glutaric aciduria type I: second revision. J Inherit Metab Dis. 2017 Jan;40(1):75-101.
  • [3]. Isasi E, et, al. Glutaric Acid Affects Pericyte Contractility and Migration: Possible Implications for GA-I Pathogenesis. Mol Neurobiol. 2019 Nov;56(11):7694-7707.
  • Merck:14,4473
  • Merck:14,4473 Beilstein: 2,IV,1934
  • Short: II/3
  • Short: III/38B
  • Short: III/5a
  • [1]. Yang SY, et, al. Production of glutaric acid from 5-aminovaleric acid by robust whole-cell immobilized with polyvinyl alcohol and polyethylene glycol. Enzyme Microb Technol. 2019 Sep;128:72-78.
  • [1]. Yang SY, et, al. Production of glutaric acid from 5-aminovaleric acid by robust whole-cell immobilized with polyvinyl alcohol and polyethylene glycol. Enzyme Microb Technol. 2019 Sep;128:72-78.
  • [2]. Boy N, et, al. Proposed recommendations for diagnosing a

安全信息

Signal word
GHS Symbol
WGK Germany1
Safety Statements
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • 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；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
Risk Statements
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
  • 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
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
RTECSMA3740000
Hazard statements
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H315 Causes skin irritation 会刺激皮肤
  • H303 May be harmfully swallowed 吞食可能有害
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Storage condition 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°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 6 gm/kg
TOXIC EFFECTS :
   Tumorigenic - active as anti-cancer agent
REFERENCE :
   BIJOAK Biochemical Journal.  (Biochemical Soc. Book Depot, POB 32, Commerce
   Way, Colchester, Essex CO2 8HP, UK)  V.1-    1906- Volume(issue)/page/year:
   34,1196,1940

其他信息

  • 戊二酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 30092626 戊二酸;胶酸 100g 99.5元 2011/04/16 G0245 戊二酸(约50%的水溶液,约4.3mol/L) Glutaric Acid (ca. 50% in Water, ca. 4.3mol/L) 500G 663元 2011/04/16 G0069 戊二酸 Glutaric Acid 25G 180元
  • 常规方法:参见“己二酸”。
  • Sigma Aldrich:110-94-1(sigmaaldrich)
  • 下游产品:丁螺环酮 --> 环庚草醚 --> 戌二酸酐 --> 壬二酸 --> 虫胶红色素 --> 巴氯芬
  • 防护措施:有毒。将戊二酸注入家兔皮下，发现对肾有剧烈的毒害。严禁口服，操作人员应戴口罩及橡胶手套。
  • 方法一:工业上可从生产已二酸的副产品中回收。实验室制备可有多种方法。1.由γ-丁内酯制备戊二酸将γ-丁内酯和氰化钾加热至190-195℃，搅拌反应2h。冷却，加入浓盐酸酸化生成戊二酸单酰胺，再加热水解即得戊二酸。收率71-75%。2.由二氢吡喃制备戊二酸将二氢吡喃与0.2N硝酸在沸水浴上加热溶解，然后在冰水浴上冷却，加入浓硝酸，二氢吡喃水解并逸出二氧化氮，当温度降至0℃时，加入硝酸钠，强烈搅拌3h。不再冷却，使温度升至25-30℃。减压蒸发、冷却，得戊二酸，收率70-75%。3.由戊二腈制备戊二酸将戊二腈与盐酸加热回流4h，然后蒸发至干，残留物含戊二酸和氯化铵，用热乙醚提取，提取液回收乙醚即得戊二酸，可用氯仿或苯重结晶。4.环己酮氧化法环己酮经硝酸氧化生产己二酸时副产戊二酸。5.副产回收法石蜡氧化生产氧化石蜡时回收戊二酸。回收方法一般采用水萃取法（或蒸馏、闪蒸和水蒸气蒸馏等）和结晶法。6.环戊酮液相氧化法。7.二氢呋喃法。实验室中也用1,3-丙二醇制备戊二酸。
  • Acros Organics:戊二酸 Glutaric acid, 99%(110-94-1)
  • MOL 文件:110-94-1.mol
  • 外观性质:无色结晶固体。
  • 图谱信息:戊二酸(110-94-1)Raman光谱 戊二酸(110-94-1)核磁图( 13 CNMR) 戊二酸(110-94-1)核磁图( 1 HNMR) 戊二酸(110-94-1)红外图谱(IR1) 戊二酸(110-94-1)质谱(MS) 戊二酸(110-94-1)红外图谱(IR2)
  • Alfa Aesar:戊二酸,99% Glutaric acid, 99%(110-94-1)
  • MSDS 信息:戊二酸(110-94-1).msds
  • 用途三:戊二酸（110-94-1）用于制备戊二酸酐、α-酮戊二酸、过氧戊二酸、B-(4-氯苯基) 戊二酸以及制成抗血压剂的中间体。作为引发剂，用合成树脂、合成橡胶 和增塑剂。在塑料工业方面，由于戊二酸（110-94-1）具有良好相溶性和温和的化学性可作清洗剂材料。
  • 易溶于无水乙醇和乙醚，溶于苯和氯仿，微溶于石油醚。存在于甜菜汁中。
  • 上游原料:硝酸 --> 氯化铵 --> 氰化钾 --> 环己酮 --> 石蜡 --> 己二酸 --> 环戊酮 --> gamma-丁内酯 --> 1,3-丙二醇 --> 四氧化二氮 --> 2,3-二氢呋喃 --> 二氢吡喃 --> 戊二腈 --> 氧化石蜡
  • 用途一:主要用于制取戊二酸酐
  • 用途四:用于有机合成，制备戊二酸二甲酯及戊二酸二乙酯等，经脱水可制得戊二酸酐。也用作合成酸树酯及合成橡胶时的引发剂。
  • 海关编码:29171990
  • 用途二:生产戊二酸酐的原料，用作合成树脂、合成橡胶聚合时的引发剂。
  • TCI Shanghai:戊二酸(约50%的水溶液,约4.3mol/L) Glutaric Acid (ca. 50% in Water, ca. 4.3mol/L)(110-94-1)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Organic Acids - Synthetic Reagents
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids - Carbonyl Compounds
  6. C1 to C5 - Carboxylic Acids
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Certified Reference Materials (CRMs) - Analytical Standards
  4. Organic CRMs TraceCERT - Certified Reference Materials (CRMs)
  5. CRM for chromatography - Organic CRMs TraceCERT
  6. Acids and Esters - CRM for chromatography
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Chromatography - Analytical Standards
  4. Food & Beverage Standards - Chromatography
  5. Nutraceuticals - Food & Beverage Standards
  6. Flavors and Fragrances - Nutraceuticals
  7. G-L - Flavors and Fragrances
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Certified Reference Materials (CRMs) - Analytical Standards
  4. Organic CRMs TraceCERT - Certified Reference Materials (CRMs)
  5. CRM for chromatography - Organic CRMs TraceCERT
  6. Organic CRMs Alphabetical - CRM for chromatography
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Carboxylic Acids
  1. Medical Research Areas
  2. Metabolism
  3. Endogenous Metabolite  (内源性代谢物)