1,4-Cyclohexanedicarboxylic acid 1,4-环己烷二甲酸

CAS 1076-97-7 MFCD00001465

化学结构图

1076-97-7
SMILES: O=C(O)C1CCC(C(=O)O)CC1

化学属性

Mol. FormulaC8H12O4
Mol. Weight172.18
Density1.314
Melting Point164-167°C
Flash Point235°(455°F)
TSCAYes
Solubility可溶
Appearance 顺反混合物为白色结晶体，溶于乙醇、丙酮和氯仿等有机溶剂。溶解度在10%左右，熔点164～167℃。反式-1，4-环已二甲酸为白色磷柱状结晶体，在水中溶解度比顺式小，熔点大于300℃。顺式-1，4-环已二甲酸为白色叶片结晶体，在水中有相当的溶解度，熔点170～171℃。
Boiling Point262.49 °C at 760 mmHg

别名和识别编码

Chemical Name1,4-Cyclohexanedicarboxylic Acid
CAS Number1076-97-7
Alfabeta NameCYCLOHEXANEDICARBOXYLICACID 14-,
MDL NumberMFCD00001465
EC Number214-068-6
Beilstein Registry Number1870377
Synonym 1,4-Cyclohexanedicarboxylic acid {LY} 1,4-Cyclohexanedicarboxylic acid {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Cyclohexanedicarboxylic acid {} {} {} {} {} {} {} {} {} {
PubChem Substance ID14106
Chemical Name Translation1,4-环己烷二甲酸
Reaxys-RN1870377
InChIInChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)
Canonical SMILESO=C(O)C1CCC(CC1)C(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   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
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分类

  • {SNA} Building Blocks, C8, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

产品应用

  • 粉末涂料用树脂；卷材涂料用树脂；在医药方面用于合成消化性溃疡药；在聚酯树脂方面，用作改性单体；高固份聚酯－三聚氰胺烘干瓷漆；凝胶涂层用不饱和聚酯树脂。
  • 在水性聚氨酯树脂中的应用：1，4-CHDA和AD（己二酸）有较好的易加工性，较低的溶液粘度，PIA（邻苯二甲酸）排在其后
  • 分散稳定性：1，4-CHDA>PIA>AD
  • 1，4－CHDA还能使树脂在硬度与柔韧性之间取得良好的平衡
  • 1，4-CHDA能用来改善丙烯酸树脂的分散性，同时还能具有良好的储存稳定性。另外，1，4－CHDA与丙烯酸树脂的协调行比间苯二甲酸（DOP）好。
  • 1，4－CHDA反应活性比PIA高

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
  • 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。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • 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。
  • 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。
  • P301+P312
  • P301+P317
  • P302+P352
  • P304+P340
  • 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。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
RTECSGU9060000
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • 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
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 3023 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 19,503,1980

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • Sigma Aldrich:1076-97-7(sigmaaldrich)
  • Acros Organics:1,4-环己烷二羧酸,顺反混合 1,4-Cyclohexanedicarboxylic acid, mixture of cis and trans, 99+%(1076-97-7)
  • 图谱信息:1,4-环己烷二甲酸(1076-97-7)Raman光谱 1,4-环己烷二甲酸(1076-97-7)红外图谱(IR1) 1,4-环己烷二甲酸(1076-97-7)质谱(MS) 1,4-环己烷二甲酸(1076-97-7)红外图谱(IR2)
  • TCI Shanghai:1,4-环己烷二甲酸(顺反异构体混合物) 1,4-Cyclohexanedicarboxylic Acid (cis- and trans- mixture),>;98.0%(GC)(T)(1076-97-7)
  • MOL 文件:1076-97-7.mol
  • 1,4-环己烷二甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010262 1,4-环已二甲酸 100g 138元 2011/04/16 C0788 1,4-环己烷二甲酸(顺反异构体混和物) 1,4-Cyclohexanedicarboxylic Acid (cis- and trans- mixture) 25G 175元 2011/04/16 C0788 1,4-环己烷二甲酸(顺反异构体混和物) 1,4-Cyclohexanedicarboxylic Acid (cis- and trans- mixture) 500G 749元
  • 用途二:粉末涂料用树脂；卷材涂料用树脂；在医药方面用于合成消化性溃疡药；在聚酯树脂方面，用作改性单体；高固份聚酯－三聚氰胺烘干瓷漆；凝胶涂层用不饱和聚酯树脂。 在水性聚氨酯树脂中的应用：1，4-CHDA和AD（己二酸）有较好的易加工性，较低的溶液粘度，PIA（邻苯二甲酸）排在其后 分散稳定性：1，4-CHDA>PIA>AD 1，4－CHDA还能使树脂在硬度与柔韧性之间取得良好的平衡 1，4-CHDA能用来改善丙烯酸树脂的分散性，同时还能具有良好的储存稳定性。另外，1，4－CHDA与丙烯酸树脂的协调行比间苯二甲酸（DOP）好。 1，4－CHDA反应活性比PIA高
  • Alfa Aesar:1,4-环己烷二羧酸,cis+trans,98% 1,4-Cyclohexanedicarboxylic acid, cis + trans, 98%(1076-97-7)
  • MSDS 信息:1,4-Cyclohexanedicarboxylic acid(1076-97-7).msds
  • 用途一:在医药方面用于合成消化性溃疡药，在聚酯树脂方面，用作改性单体，改善聚酯树脂变黄，在不改变硬度的情况下，改善其挠性（软性）。
  • 具有在环状结构上的1，4位对称取代的伯羧基团的二元酸。溶于水。

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. C8 - Carboxylic Acids
  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. C8 - Carboxylic Acids
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. 4-Substituted Cyclohexanecarboxylic Acids
  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
  6. C7

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