(S)-(-)-Alpha-Methylbenzylamine (S)-(-)-1-苯基乙胺

CAS 2627-86-3 MFCD00064406

化学结构图

2627-86-3
SMILES: C[C@H](N)c1ccccc1

化学属性

Mol. FormulaC8H11N
Mol. Weight121.18
Density0.95
Refractive index1.5250 to 1.5280
Flash Point79°C(lit.)
TSCAYes
Boiling Point187 °C at 760 mmHg
Melting Point-10 °C
Vapor Pressure0.5 mmHg ( 20 °C)
Solubility略溶于水

别名和识别编码

Chemical Name(S)-(-)-Alpha-Methylbenzylamine
CAS Number2627-86-3
Alfabeta NamePHENYLETHYLAMINE S1(())----
MDL NumberMFCD00064406
Synonym (S)-1-Phenylethanamine {LY} (S)-1-Phenylethanamine {} {LY} (S)-1-Phenylethanamine {} {} {LY} (S)-1-Phenylethanamine {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (S)-1-Phenylethanamine {} {} {} {} {} {} {} {} {} {} {} {} {}
EC Number220-098-0
Beilstein Registry Number12,1093
Merck Number14,6026
PubChem Substance ID75818
Reaxys-RN3648466
Chemical Name Translation(S)-(-)-1-苯基乙胺
LabNetwork Molecule IDLN00179043
InChIInChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m0/s1
Canonical SMILESN[C@@H](C)C1=CC=CC=C1
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分类

  • {SNA} Amines, Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Organic Building Blocks
  • Chiral Reagents
  • {SNA} Analytical Reagents, Analytical/Chromatography, Chiral, Chiral Derivatization Reagents, Chiral GC Derivatization Reagents, Derivatization Reagents, Derivatization Reagents HPLC
  • Amines
  • {SNA} Amines, Asymmetric Synthesis, Chemical Synthesis, Chiral Building Blocks, Chiral Resolution Reagents, Chiral Resolving Reagents, Organic Building Blocks
  • Aromatics

产品应用

  • Used in a one-pot, multi-component synthesis of a highly substituted, chiral pyrrole

相关文献及参考

  • For use as a chiral auxiliary in the asymmetric synthesis of (R)-(-)-10-methyl-1(9)-octal-2-one, see: Org. Synth. Coll., 9, 610 (1998):
  • Merck: 13,6054 Beilstein:12,1093
  • Merck: 13,6054

安全信息

Warnings IRRITANT
Signal word Danger
GHS Symbol
WGK Germany1
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；
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗；
  • 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）；
  • S20 When using do not eat or drink 使用时，不得进食，饮水；
Risk Statements
  • R34 Causes burns 会导致灼伤
  • R35 Causes severe burns 会导致严重灼伤
  • R21/22 Harmful in contact with skin and if swallowed 皮肤接触和不慎吞咽有害
  • 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
  • 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
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • 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。
  • 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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P301+P330+P331+P310
  • P314 Get medical advice/attention if you feel unwell. 获取医疗咨询/就医，如果你觉得不舒服
  • P308+P313
  • P303+P361+P353
  • P370+P378
  • P304+P340
  • 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。
  • P304+P340+P310
  • P403+P235
  • P301+P330+P331
  • P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
  • P303+P361+P353+P310+P363
Packing GroupII
UN Number 2735 UN2735 UN 2922 8/PG 2 2922
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light Air Sensitive {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {}
Hazard statements
  • H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
  • H302 Harmful if swallowed 吞食有害
  • H311 Toxic in contact with skin 皮肤接触中毒
  • H227 Combustible liquid 可燃液体
Personal Protective Equipment Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Hazard Codes C C,Xi
RTECSDP5775000
Hazard Class8/6.1

其他信息

  • MSDS 信息:L(-)-alpha-Methylbenzylamine(2627-86-3).msds
  • 上游原料:氢氧化钠 --> 甲醇 --> 乙醚 --> 左旋酒石酸 --> alpha-甲基苄胺
  • 比旋光度:-40 ° (neat)
  • 海关编码:29214980
  • 敏感性:Air Sensitive
  • S-1-苯乙胺价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P0793 (S)-(-)-1-苯乙胺 (S)-(-)-1-Phenylethylamine 25ML 424元 2014/06/02 P0793 (S)-(-)-1-苯乙胺 (S)-(-)-1-Phenylethylamine 500ML 3140元 2010/06/21 151831000 S-1-苯乙胺 L(-)-alpha-Methylbenzylamine , 99+%, (99% ee) 100 GR 1555元
  • 食品添加剂最大允许使用量最大允许残留量标准:添加剂中文名称 允许使用该种添加剂的食品中文名称 添加剂功能 最大允许使用量（g/kg） 最大允许残留量（g/kg） 苯乙胺 食品 食品用香料 用于配制香精的各香料成分不得超过在GB 2760中的最大允许使用量和最大允许残留量
  • Alfa Aesar:(S)-(-)-1-苯基乙胺,ChiPros99+%,ee99.5% (S)-(-)-1-Phenylethylamine, ChiPros 99+%, ee 99.5%(2627-86-3)
  • 下游产品:(R)-(+)-叔丁基亚磺酰胺 --> (S)-(-)-2-羧基环丁胺 --> R-1,1'-联-2-萘酚 --> R-3-氨基奎宁环二盐酸盐 --> S-1,1'-联-2-萘酚 --> (R)-(+)-降冰片胺 --> S-氰戊菊酯 --> (S,S)-(-)-双(Α-甲基苄基)胺盐酸盐 --> (S)-(-)-N-苄基-alpha-甲基苄胺 --> (S,S)-双-(1-苯基乙基)胺 --> (R)-(+)-N-苄基-1-苯乙胺
  • MOL 文件:2627-86-3.mol
  • Sigma Aldrich:2627-86-3(sigmaaldrich)
  • F:3-10-23-34
  • 蒸气压:0.5 mm Hg ( 20 °C)
  • 图谱信息:S-1-苯乙胺(2627-86-3)红外图谱(IR2) S-1-苯乙胺(2627-86-3)红外图谱(IR1) S-1-苯乙胺(2627-86-3)质谱(MS) S-1-苯乙胺(2627-86-3)Raman光谱 S-1-苯乙胺(2627-86-3)核磁图( 1 HNMR) S-1-苯乙胺(2627-86-3)核磁图( 13 CNMR)
  • Hazard Note:Irritant
  • 微溶于水，溶于大多数有机溶剂，和醇及醚混溶。
  • Acros Organics:L(-)-alpha-甲基苄胺 L(-)-alpha-Methylbenzylamine, 99+%, (99% ee)(2627-86-3)
  • TCI Shanghai:(S)-(-)-1-苯基乙胺 (S)-(-)-1-Phenylethylamine,>;98.0%(GC)(2627-86-3)
  • 存储注意事项:空气敏感

系列性分类

  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Reagents
  3. Derivatization Reagents 衍生分析试剂
  4. Chiral Derivatization Reagents - Derivatization Reagents
  1. Chemical Synthesis 化学合成
  2. Asymmetric Synthesis 不对称合成
  3. Chiral Resolution Reagents - Asymmetric Synthesis
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Reagents
  3. Derivatization Reagents 衍生分析试剂
  4. Derivatization Reagents HPLC - Derivatization Reagents
  5. Chiral - Derivatization Reagents HPLC
  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. Heterocyclic Building Blocks 杂环合成砌块
  4. Others 其他杂环
  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. Amines - Organic Building Blocks
  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. Analytical & Chromatography 分析化学与色谱
  2. HPLC
  3. Derivatization Reagents
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Amides 酰胺
  1. Analytical & Chromatography 分析化学与色谱
  2. Derivatization Reagents
  3. Chiral Derivatization
  1. Analytical & Chromatography 分析化学与色谱
  2. Derivatization Reagents
  3. Derivatization Reagents HPLC

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