CAS Number3618-96-0
SynonymsAcetyl-L-phenylalanine methyl ester; Phenylalanine, N-acetyl-, methyl ester; N-Acetyl-l-phenylalanine methyl ester; (S)-N-Acetyl-3-phenylalanine methyl ester; Methyl N-acetylphenylalaninate; (+)-(S)-L-phenylalaine(S)-(+)-N-Acetyl-L-phenylalanineMethylEster
Molecular FormulaC12H15NO3
Molecular Weight221.252
Density1.1±0.1 g/cm3
Boiling Point391.0±30.0 °C at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3618-96-0 |
| Catalog No. | 2A-9082589 |
| Chinese Name | N-乙酰基-L-苯丙氨酸甲酯 |
| Synonyms | Acetyl-L-phenylalanine methyl ester; Phenylalanine, N-acetyl-, methyl ester; N-Acetyl-l-phenylalanine methyl ester; (S)-N-Acetyl-3-phenylalanine methyl ester; Methyl N-acetylphenylalaninate; (+)-(S)-L-phenylalaine(S)-(+)-N-Acetyl-L-phenylalanineMethylEster |
| Molecular Formula | C12H15NO3 |
| Molecular Weight | 221.252 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 391.0±30.0 °C at 760 mmHg |
| Storage Condition | Room temperature, dry and sealed |
| HTC | 2924299090 |
| SMILES | COC(=O)C(Cc1ccccc1)NC(C)=O |
| InChI | InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14) |
| InChI Key | IKGHIFGXPVLPFD-NSHDSACASA-N |
| MSDS | msds/82589_1_3618_96_0.pdf |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point: Flash point:No data Molecular formula:C12H15NO3 Molecular weight:221.3 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Safety Information HS Code 2924299090 Synthetic Route (Z)-METHYL 2-AC... 60676-51-9 Methyl N-acetyl... Literature: Bunlaksananusorn, Tanasri; Polborn, Kurt; Knochel, Paul Angewandte Chemie - International Edition, 2003 , vol. 42, # 33 p. 3941 - 3943 (E)-α-(N-... 64590-81-4 Methyl N-acetyl... Methyl L-phenyl... Ethanoic anhydr... Methyl N-acetyl... Literature: De Marco, Rosaria; Gioia, Maria Luisa Di; Leggio, Antonella; Liguori, Angelo; Viscomi, Maria Caterina European Journal of Organic Chemistry, 2009 , # 22 p. 3795 - 3800 Precursor & DownStream Precursor 9 CAS#:60676-51-9 (Z)-METHYL 2-AC... CAS#:64590-81-4 (E)-α-(N-acylam... CAS#:2577-90-4 Methyl L-phenyl... CAS#:108-24-7 Ethanoic anhydride DownStream 7 CAS#:18934-57-1 L-Phenylalanine... CAS#:103-25-3 Methyl 3-phenyl... CAS#:110-19-0 Isobutyl acetate CAS#:7524-50-7 Methyl L-phenyl... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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