(R)-(-)-Mandelic Acid D-扁桃酸

CAS 611-71-2 MFCD00064251

化学结构图

611-71-2
SMILES: O=C(O)C(O)C1CCCCC1

化学属性

Mol. FormulaC8H8O3
Mol. Weight152.15
Melting Point131-133°C
Density1.321
TSCAYes
Refractive index-153.5 ° (C=1, H2O)
Stability对光敏感
Boiling Point321.8°C at 760 mmHg
Flash Point>190°C

别名和识别编码

Chemical Name(R)-(-)-Mandelic Acid
CAS Number611-71-2
Alfabeta NameMANDELICACID R(())---
MDL NumberMFCD00064251
Synonym D-(-)-Mandelic acid {LY} D-(-)-Mandelic acid {} {LY} D-(-)-Mandelic acid {} {} {LY} D-(-)-Mandelic acid {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} D-(-)-Mandelic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Beilstein Registry Number2691094
EC Number210-276-6
Reaxys-RN2691094
PubChem Substance ID87572674
Chemical Name Translation(R)-(-)-扁桃酸
LabNetwork Molecule IDLN00173227
InChIInChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)/t7-/m1/s1
Canonical SMILESOC([C@H](O)C1=CC=CC=C1)=O
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分类

  • {SNA} Analytical Standards, Chromatography, EP Standards, EP Standards S - T, Pharmaceutical Standards, Pharmacopeia Standards, 分析/色谱
  • Chiral Reagents
  • {SNA} Asymmetric Synthesis, Carboxylic Acids, Chemical Synthesis, Chiral Building Blocks, Chiral Resolution Reagents, Chiral Resolving Reagents, Organic Building Blocks
  • Pharmaceuticals
  • {SNA} Alcohols, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carboxylic acid; alcohol; chiral; 1fragment
  • Intermediates & Fine Chemicals
  • {SNA} Analytical Standards, Analytical/Chromatography, Chromatography, EP Standards,
  • Aromatics

产品应用

  • 分析碱的试剂，经由酯分析醇， 经由二氧戊环立体选择性的α-烷基化分析

相关文献及参考

  • Beilstein:10,194
  • Short: LC
  • Chiral intermediate and resolving agent for organic bases. For resolution of alcohols as their mandelate esters, see: J. Org. Chem., 48, 3548 (1983). For review of resolution of alcohols, see: Org. React., 2, 376 (1944).
  • Pessela, B., et al.: Enzyme Microb. Technol., 40, 310 (2007),
  • Carrasco-Lopez, C., et al.: J. Biol. Chem., 284, 4365 (2009),
  • Short: EINECS
  • Short: III/5a
  • Reagent for determination of enantiomeric excess of alcohols by chiral HPLC. For determination of ee of amines by NMR, see: J. Org. Chem., 53, 5335 (1988).

安全信息

Warnings IRRITANT
GHS Symbol
Signal word Danger
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
WGK Germany1
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • P302+P350
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P332+P313
  • P337+P313
  • 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
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • 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；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
Risk Statements
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
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 {} {} {} {} {} {}
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard Codes Xi

其他信息

  • 用途一:用于有机合成及医药工业
  • 下游产品:
  • TCI Shanghai:D-(-)-扁桃酸 D-(-)-Mandelic Acid,>;99.0%(GC)(T)(611-71-2)
  • 存储注意事项:光敏感
  • MSDS 信息:2-Phenylglycolic acid(611-71-2).msds
  • 水中溶解度: 100 g/l (25°C),溶于乙醇和醚
  • Hazard Note:Irritant/Light Sensitive
  • 用途二:分析碱的试剂，经由酯分析醇， 经由二氧戊环立体选择性的α-烷基化分析
  • 扁桃酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010399 D-扁桃酸 50g 165元 2011/04/16 M0662 D-(-)-扁桃酸 D-(-)-Mandelic Acid 25G 446元 2011/04/16 M0662 D-(-)-扁桃酸 D-(-)-Mandelic Acid 500G 5560元
  • Alfa Aesar:(R)-(-)-扁桃酸,ChiPros99+%,ee99+% (R)-(-)-Mandelic acid, ChiPros 99+%, ee 99+%(611-71-2)
  • 比旋光度:-150 ° (c=2.5, H2O)
  • Acros Organics:?-(-)-扁桃酸 (R)-(-)-Mandelic acid, 99%(611-71-2)
  • MOL 文件:611-71-2.mol
  • 检测方法:HPLC,NMR
  • 图谱信息:扁桃酸(611-71-2)Raman光谱 扁桃酸(611-71-2)核磁图( 1 HNMR) 扁桃酸(611-71-2)红外图谱(IR2) 扁桃酸(611-71-2)红外图谱(IR1) 扁桃酸(611-71-2)质谱(MS)
  • 海关编码:29181980
  • Sigma Aldrich:611-71-2(sigmaaldrich)
  • 敏感性:Light Sensitive

系列性分类

  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Resolution Reagents - Asymmetric Synthesis
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Resolution Reagents - Asymmetric Synthesis
  4. Chiral Resolving Reagents - Chiral Resolution Reagents
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Resolution Reagents - Asymmetric Synthesis
  4. Chiral Resolving Reagents - Chiral Resolution Reagents
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Others 其他杂环
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Alcohols - Oxygen Compounds
  6. C7 to C8 - Alcohols
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  4. Organic Building Blocks - Chiral Building Blocks
  5. Carboxylic Acids - Organic Building Blocks
  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. Aromatic acids
  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Optical Resolution
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Building Blocks 手性分子砌块
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carboxylic Acid Salts 羧酸盐
  1. Functional Group 官能团索引
  2. alpha-hydroxyacid

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