Methyl 3-aminobenzoate, 98% 3-氨基苯甲酸甲酯

CAS 4518-10-9 MFCD00017102

化学结构图

4518-10-9
SMILES: COC(=O)c1cccc(N)c1

化学属性

Mol. FormulaC8H9NO2
Mol. Weight151.16
Density1.232
Melting Point50-54°C
TSCAYes
Boiling Point281.5°C at 760 mmHg

别名和识别编码

Chemical NameMethyl 3-aminobenzoate, 98%
CAS Number4518-10-9
Alfabeta NameAMINOBENZOICACIDMETHYLESTER 3--
MDL NumberMFCD00017102
Synonym Methyl 3-aminobenzoate {LY} Methyl 3-aminobenzoate {} {LY} Methyl 3-aminobenzoate {} {} {LY} Methyl 3-aminobenzoate {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 3-aminobenzoate {} {} {} {} {} {} {} {} {} {
EC Number224-842-5
Beilstein Registry Number1101468
PubChem Substance ID87562951
Chemical Name Translation3-氨基苯甲酸甲酯
Reaxys-RN1101468
InChIKeyVZDNXXPBYLGWOS-UHFFFAOYSA-N
LabNetwork Molecule IDLN00010164
Canonical SMILESO=C(OC)C1=CC=CC(N)=C1
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 1fragment
  • {SNA} Aromatic Amino Acids, Chemical Biology, Chemical Synthesis, Peptide Chemistry, Unnatural Amino Acid Derivatives

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: IV/1a Title: Densities of Liquid Systems: Nonaqueous Systems and Ternary Aqueous Systems Author: Lacmann, R.; Synowietz, C. Editor: Schäfer, Kl. Source: Landolt-Börnstein, New Series Volume: IV/1a Year: 1974 ISBN: 3-540-06269-6 ISBN: 978-3-540-06269-1 Internet Resource: DOI:10.1007/b20003 RefComment: X, 716 pages. Hardcover Abstract: Volume IV/1 contains information on the densities of liquid systems. It may be considered as a supplement to volume II/1 of the 6th Edition, which contains only a few data on nonaqueous systems. Data are not listed for all systems but primarily for those of greater interest where data for a larger range of concentrations were available.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 19

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • 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；
  • 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 Wear suitable gloves 戴适当手套；
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
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
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
  • 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
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
Hazard Codes Xn,Xi
Storage condition 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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 3-氨基苯甲酸甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A1499 3-氨基苯甲酸甲酯 Methyl 3-Aminobenzoate 25G 1090元 2014/06/02 A1499 3-氨基苯甲酸甲酯 Methyl 3-Aminobenzoate 5G 351元 2010/06/21 413950250 3-氨基苯甲酸甲酯 Methyl 3-aminobenzoate 98% 25 GR 3309元
  • Acros Organics:3-氨基苯甲酸甲酯 Methyl 3-aminobenzoate, 98%(4518-10-9)
  • TCI Shanghai:3-氨基苯甲酸甲酯 Methyl 3-Aminobenzoate,>;98.0%(GC)(T)(4518-10-9)
  • Alfa Aesar:3-氨基苯甲酸甲酯,98+% Methyl 3-aminobenzoate, 98+%(4518-10-9)
  • 图谱信息:3-氨基苯甲酸甲酯(4518-10-9)质谱(MS) 3-氨基苯甲酸甲酯(4518-10-9)核磁图( 1 HNMR) 3-氨基苯甲酸甲酯(4518-10-9)红外图谱(IR2) 3-氨基苯甲酸甲酯(4518-10-9)核磁图( 13 CNMR) 3-氨基苯甲酸甲酯(4518-10-9)红外图谱(IR1)
  • Sigma Aldrich:4518-10-9(sigmaaldrich)
  • Hazard Note:Irritant
  • 检测方法:GC,NMR
  • MOL 文件:4518-10-9.mol
  • 上游原料:甲醇 --> 氧氯化硫 --> 3-氨基苯甲酸

系列性分类

  1. Chemical Synthesis 化学合成
  2. Chemical Biology 生物化学
  3. Peptide Chemistry 多肽化学
  4. Unnatural Amino Acid Derivatives 人工合成氨基酸
  5. Aromatic Amino Acids - Unnatural Amino Acid Derivatives

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