Isononanoic Acid 3,5,5-三甲基己酸

CAS 3302-10-1 MFCD00020507

化学结构图

3302-10-1
SMILES: CC(CC(=O)O)CC(C)(C)C

化学属性

Mol. FormulaC9H18O2
Mol. Weight158.24
Density0.910
Refractive index1.4280 to 1.4310
Flash Point125°C(lit.)
TSCAYes
Boiling Point120°C/13mmHg(lit.)
Melting Point-70°

别名和识别编码

Chemical NameIsononanoic Acid
Synonym 3,5,5-Trimethylhexanoic acid {LY} 3,5,5-Trimethylhexanoic acid {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3,5,5-Trimethylhexanoic acid {} {} {} {} {} {} {}
MDL NumberMFCD00020507
CAS Number3302-10-1
EC Number221-975-0
Beilstein Registry Number2(3)833
Reaxys-RN1749506
PubChem Substance ID90960
Chemical Name Translation3,5,5-三甲基己酸
InChIKeyOILUAKBAMVLXGF-UHFFFAOYSA-N
LabNetwork Molecule IDLN00238987
InChIInChI=1S/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11)
Canonical SMILESCC(C)(C)CC(C)CC(O)=O
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分类

  • {uni_hamburg} no charge; carboxylic acid; racemate; 1fragment

相关文献及参考

  • Beilstein:2(3)833
  • Short: EINECS
  • Short: IV/1a

安全信息

Risk Statements
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • 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
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • 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；
  • 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；
  • 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；
Hazard Codes Xi
Signal word
Hazard statements
  • H302 Harmful if swallowed 吞食有害
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。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P332+P313
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338+P337+P313
  • P301+P312+P330
  • 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。
Packing GroupIII
Hazard Class8
UN Number 3265
GHS Symbol
Storage condition

其他信息

  • MOL 文件:3302-10-1.mol
  • 图谱信息:3,5,5-三甲基己酸(3302-10-1)红外图谱(IR1) 3,5,5-三甲基己酸(3302-10-1)核磁图( 1 HNMR) 3,5,5-三甲基己酸(3302-10-1)质谱(MS) 3,5,5-三甲基己酸(3302-10-1)核磁图( 13 CNMR)
  • Sigma Aldrich:3302-10-1(sigmaaldrich)
  • 外观性质:无色透明液体，微溶于水。具有腐蚀性，对皮肤和眼睛以及呼吸系统有刺激性，注意避免与皮肤以及眼睛接触。是一种具有特殊用途的精细化工中间体。 熔点：-70℃沸点：120 °C/13mmHg 密度：0.91闪点：125℃折光率nD20: 1.4278-1.4298
  • 无色透明液体，微溶于水。具有腐蚀性，对皮肤和眼睛以及呼吸系统有刺激性，注意避免与皮肤以及眼睛接触。是一种具有特殊用途的精细化工中间体。
  • 3,5,5-三甲基己酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 T0630 3,5,5-三甲基己酸 3,5,5-Trimethylhexanoic Acid 500ML 637元 2014/06/02 T0630 3,5,5-三甲基己酸 3,5,5-Trimethylhexanoic Acid 25ML 224元 2010/05/25 L13360 3,5,5-三甲基己酸, 97% 3,5,5-Trimethylhexanoic acid, 97% 500ml 848元
  • Acros Organics:3,5,5-三甲基己酸 3,5,5-Trimethylhexanoic acid, 95%(3302-10-1)
  • TCI Shanghai:3,5,5-三甲基己酸 3,5,5-Trimethylhexanoic Acid,>;95.0%(GC)(3302-10-1)
  • Alfa Aesar:3,5,5-三甲基己酸,97% 3,5,5-Trimethylhexanoic acid, 97%(3302-10-1)
  • 3,5,5-三甲基己酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 T0630 3,5,5-三甲基己酸 3,5,5-Trimethylhexanoic Acid 500ML 526元 2011/04/16 T0630 3,5,5-三甲基己酸 3,5,5-Trimethylhexanoic Acid 25ML 184元 2010/05/25 L13360 3,5,5-三甲基己酸, 97% 3,5,5-Trimethylhexanoic acid, 97% 500ml 848元
  • 用途一:油漆和涂料催干剂的中间体，用于生产作为润滑剂和增塑剂的酯，以及生产作为聚合催化剂的过氧化物。

系列性分类

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