CAS Number502649-25-4
Synonyms3-Phenylpiperazine,N1-BOC protected; N-1-Boc-3-phenylpiperazine; tert-butyl 3-phenyl-piperazine-1-carboxylate; 3-phenylpiperazine-1-carboxylic acid tert-butyl ester; MFCD03840082; 2-Methyl-2-propanyl-3-phenyl-1-piperazincarboxylat; N-Boc-3-phenylpiperazine; 2-Methyl-2-propanyl 3-phenyl-1-piperazinecarboxylate
Molecular FormulaC15H22O2N2
Molecular Weight262.35
Purity98.00%
Density1.1±0.1 g/cm3
Boiling Point371.4±30.0 °C at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 502649-25-4 |
| Catalog No. | 2A-9057489 |
| Chinese Name | N-1-Boc-3-苯基哌嗪 |
| Synonyms | 3-Phenylpiperazine,N1-BOC protected; N-1-Boc-3-phenylpiperazine; tert-butyl 3-phenyl-piperazine-1-carboxylate; 3-phenylpiperazine-1-carboxylic acid tert-butyl ester; MFCD03840082; 2-Methyl-2-propanyl-3-phenyl-1-piperazincarboxylat; N-Boc-3-phenylpiperazine; 2-Methyl-2-propanyl 3-phenyl-1-piperazinecarboxylate |
| Molecular Formula | C15H22O2N2 |
| Molecular Weight | 262.35 |
| Purity | 98.00 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 371.4±30.0 °C at 760 mmHg |
| Storage Condition | 2-8°C |
| HTC | 2933599090 |
| MDL Number | MFCD03840082 |
| SMILES | CC(C)(C)OC(=O)N1CCNC(c2ccccc2)C1 |
| InChI | InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-10-9-16-13(11-17)12-7-5-4-6-8-12/h4-8,13,16H,9-11H2,1-3H3 |
| InChI Key | HRRFJZULVYGVNJ-UHFFFAOYSA-N |
| MSDS | msds/57489_1_502649_25_4.pdf |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels, refrigerated. 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:C15H22N2O2 Molecular weight:262.4 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 Hazard Codes Xi HS Code 2933599090 Synthetic Route Total: 1 Page 2-Phenylpiperazine CAS#:5271-26-1 Di-tert-butyl d... CAS#:24424-99-5 N-1-Boc-3-pheny... CAS#:502649-25-4 Literature: DAC S.r.l. Patent: EP2133334 A1, 2009 ; Location in patent: Page/Page column 20 ; 2-Phenylpyrazine CAS#:29460-97-7 N-1-Boc-3-pheny... CAS#:502649-25-4 Literature: Blythin, David J.; Chen, Xiao; Piwinski, John J.; Shih, Neng-Yang; Shue, Ho-Jane; Anthes, John C.; McPhail, Andrew T. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 21 p. 3161 - 3165 Precursor & DownStream Precursor 3 CAS#:5271-26-1 2-Phenylpiperazine CAS#:24424-99-5 Di-tert-butyl d... CAS#:29460-97-7 2-Phenylpyrazine DownStream 1 CAS#:912763-14-5 2-Phenyl-pipera... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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