2,2-Dimethylhexanoic Acid 2,2-二甲基己酸

CAS 813-72-9 MFCD00965097

化学结构图

813-72-9
SMILES: CCCCC(C)(C)C(=O)O

化学属性

Mol. FormulaC8H16O2
Mol. Weight144.21
Density0.913
Refractive index1.4250 to 1.4290
TSCANo
Boiling Point216-220 °C at 760 mmHg
Flash Point216-220°C
Melting Point-21.25 °C

别名和识别编码

Chemical Name2,2-Dimethylhexanoic Acid
CAS Number813-72-9
EC Number000-000-0
Beilstein Registry Number2(4)1009
MDL NumberMFCD00965097
Reaxys-RN1749961
PubChem Substance ID163217
Synonym 2,2-Dimethylhexanoic acid {LY} 2,2-Dimethylhexanoic acid {} {LY} 2,2-Dimethylhexanoic acid {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,2-Dimethylhexanoic acid {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation2,2-二甲基己酸
LabNetwork Molecule IDLN01286882
InChIInChI=1S/C8H16O2/c1-4-5-6-8(2,3)7(9)10/h4-6H2,1-3H3,(H,9,10)
Canonical SMILESCCCCC(C)(C)C(=O)O
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安全信息

Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • 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；
  • 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；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
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
  • R34 Causes burns 会导致灼伤
Precautionary statements
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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
  • 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。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P301+P330+P331+P310
  • P303+P361+P353
  • P304+P340
  • P304+P340+
Packing GroupIII
UN Number UN3265 3265
Hazard statements
  • H290 May be corrosive to metals 可能腐蚀金属。
Hazard Codes Xi
Hazard Class8
Storage condition

其他信息

  • MOL 文件:813-72-9.mol
  • 下游产品:
  • Alfa Aesar:2,2-二甲基戊酸,94% 2,2-Dimethylhexanoic acid, 94%(813-72-9)
  • Hazard Note:Irritant
  • 图谱信息:2,2-二甲基己酸(813-72-9)核磁图( 13 CNMR) 2,2-二甲基己酸(813-72-9)质谱(MS) 2,2-二甲基己酸(813-72-9)红外图谱(IR1) 2,2-二甲基己酸(813-72-9)核磁图( 1 HNMR)
  • TCI Shanghai:2,2-二甲基己酸 2,2-Dimethylhexanoic Acid(813-72-9)
  • 2,2-二甲基己酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D2809 2,2-二甲基己酸 2,2-Dimethylhexanoic Acid 5G 4510元 2014/06/02 D2809 2,2-二甲基己酸 2,2-Dimethylhexanoic Acid 1G 1370元 2010/05/25 L14664 2,2-二甲基戊酸, 94% 2,2-Dimethylhexanoic acid, 94% 250mg 480元

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

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