Methyl 2-Amino-3-(4-Hydroxyphenyl)-2-Methylpropanoate Hydrochloride 2-氨基-3-(4-羟基苯基)-2-甲基丙酸甲酯盐酸盐
CAS 7361-31-1 MFCD00012606
化学结构图
SMILES: COC(=O)C(C)(N)Cc1ccc(O)cc1.Cl
化学属性
| Mol. Formula | C11H16ClNO3 |
|---|---|
| Mol. Weight | 245.70 |
| Melting Point | 192 °C |
| Solubility | H2O: 50 mg/mL, clear, faintly yellow |
别名和识别编码
| Chemical Name | Methyl 2-Amino-3-(4-Hydroxyphenyl)-2-Methylpropanoate Hydrochloride |
|---|---|
| CAS Number | 7361-31-1 |
| Synonym | α-Methyltyrosine methyl ester (hydrochloride) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} |
| Beilstein Registry Number | 5163031 |
| PubChem Substance ID | 11957616 |
| EC Number | 230-900-0 |
| MDL Number | MFCD00012606 |
| Reaxys-RN | 5163031 |
| Chemical Name Translation | 2-氨基-3-(4-羟基苯基)-2-甲基丙酸甲酯盐酸盐 |
| Wiswesser Line Notation | QR D1XZ1&VO1 &GH, -R |
| InChIKey | LBSDGCNTBFGZKY-VPLDNDRNSA-N |
| LabNetwork Molecule ID | LN00198970 |
| InChI | InChI=1S/C11H15NO3.ClH/c1-11(12,10(14)15-2)7-8-3-5-9(13)6-4-8;/h3-6,13H,7,12H2,1-2H3;1H |
| Canonical SMILES | NC(CC1=CC=C(C=C1)O)(C)C(OC)=O.[H]Cl |
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分类
- {SA} Bioactive Small Molecules, Cell Biology, Cell Signaling and Neuroscience, Enzyme Inhibitors, M, Neuroscience, Neurotransmission,
- {SNA} Enzyme Inhibitors, Neuroscience, Neurotransmission, Neurotransmitter Metabolism, Tyrosine Hydroxylase, 细胞信号转导和神经科学, 细胞生物学
- {SNA} Bioactive Small Molecules, Cell Signaling and Neuroscience,
- {SNA} Bioactive Small Molecule Alphabetical Index, Enzyme Inhibitors, M, Neuroscience, Neurotransmission, Neurotransmitter Metabolism, Tyrosine Hydroxylase, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
产品应用
- A metabolite of Dopamine and Noradrenaline.
相关文献及参考
- Pfeiffer, F.R.
- FT-IR 2 (2), 2819:B / FT-IR 1 (2), 284:D / IR-Spectra (3), 1023:D / IR-Spectra (2), 896:C / NMR-Reference 2 (2), 255:C / RegBook 1 (2), 1887:A / Sax 6 , 1942 / Sigma FT-IR 1 (1), 224:C / Structure Index 1 , 302:A:6
安全信息
- 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；
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 400 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 28,227,1974
其他信息
- 图谱信息:Α-甲基-DL-酪氨酸甲酯盐酸盐(7361-31-1)核磁图( 1 HNMR) Α-甲基-DL-酪氨酸甲酯盐酸盐(7361-31-1)核磁图( 13 CNMR) Α-甲基-DL-酪氨酸甲酯盐酸盐(7361-31-1)红外图谱(IR1) Α-甲基-DL-酪氨酸甲酯盐酸盐(7361-31-1)质谱(MS)
- Sigma Aldrich:7361-31-1(sigmaaldrich)
- MOL 文件:7361-31-1.mol
- TCI Shanghai:α-甲基-DL-酪氨酸甲酯盐酸盐 alpha-Methyl-DL-tyrosine Methyl Ester Hydrochloride,>;98.0%(LC)(T)(7361-31-1)
- Α-甲基-DL-酪氨酸甲酯盐酸盐价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M1373 α-甲基-DL-酪氨酸甲酯盐酸盐 alpha-Methyl-DL-tyrosine Methyl Ester Hydrochloride 1G 1780元
- F:10
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