| Chemical & Physical Properties | |
|---|---|
| CAS Number | 16462-27-4 |
| Catalog No. | 2A-9037104 |
| Chinese Name | 2,4-二氨基嘧啶-5-腈 |
| Synonyms | MFCD00085600; 2,4-diaminopyrimidine-5-carbonitrile |
| Molecular Formula | C5H5N5 |
| Molecular Weight | 135.13 |
| Purity | 98.00 |
| Density | 1.45g/cm3 |
| Boiling Point | 498.2ºC at 760mmHg |
| Appearance | solid |
| Storage Condition | Refrigerator |
| HTC | 2933599090 |
| PubChem ID | 423714 |
| SMILES | N#Cc1cnc(N)nc1N |
| InChI | InChI=1S/C5H5N5/c6-1-3-2-9-5(8)10-4(3)7/h2H,(H4,7,8,9,10) |
| InChI Key | OYUQCQCQLDTRHQ-UHFFFAOYSA-N |
| 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:C5H5N5 Molecular weight:135.1 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 Guanidine hydro... CAS#:50-01-1 Ethoxymethylene... CAS#:123-06-8 2,4-Diamino-5-c... CAS#:16462-27-4 Literature: Karoli, Tomislav; Mamidyala, Sreeman K.; Zuegg, Johannes; Fry, Scott R.; Tee, Ernest H.L.; Bradford, Tanya A.; Madala, Praveen K.; Huang, Johnny X.; Ramu, Soumya; Butler, Mark S.; Cooper, Matthew A. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 7 p. 2428 - 2433 2,4-Diamino-5-p... CAS#:42310-45-2 2,6-Diethylphenol CAS#:1006-59-3 2,4-Diamino-5-c... CAS#:16462-27-4 4-(2,4-diamino-... CAS#:36821-97-3 Literature: Burroughs Wellcome Co. Patent: US4116958 A1, 1978 ; Guanidine nitrate CAS#:506-93-4 Ethoxymethylene... CAS#:123-06-8 2,4-Diamino-5-c... CAS#:16462-27-4 Literature: Bag, Seema; Tawari, Nilesh R.; Degani, Mariam S.; Queener, Sherry F. Bioorganic and Medicinal Chemistry, 2010 , vol. 18, # 9 p. 3187 - 3197 Precursor & DownStream Precursor 8 CAS#:50-01-1 Guanidine hydro... CAS#:123-06-8 Ethoxymethylene... CAS#:42310-45-2 2,4-Diamino-5-p... CAS#:1006-59-3 2,6-Diethylphenol DownStream 5 CAS#:42310-45-2 2,4-Diamino-5-p... CAS#:4458-18-8 2,4-diamino-5-a... CAS#:20781-06-0 2,4-Diaminopyri... CAS#:66131-74-6 2,4-diaminopyri... |
| 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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