CAS Number100130-05-0
Synonyms5-Amino-2-(methylsulfanyl)-4-pyrimidinecarboxylic acid; 5-amino-2-methylsulfanylpyrimidine-4-carboxylic acid; 5-Amino-2-(methylthio)pyrimidine-4-carboxylic acid; 5-Amino-2-(methylsulfanyl)pyrimidine-4-carboxylic acid
Molecular FormulaC6H7N3O2S
Molecular Weight185.204
Density1.5±0.1 g/cm3
Boiling Point435.0±30.0 °C at 760 mmHg
Melting Point190-191.5℃ (decomposition)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 100130-05-0 |
| Catalog No. | 2A-9072553 |
| Chinese Name | 2-(甲硫基)-5-氨基嘧啶-4-甲酸 |
| Synonyms | 5-Amino-2-(methylsulfanyl)-4-pyrimidinecarboxylic acid; 5-amino-2-methylsulfanylpyrimidine-4-carboxylic acid; 5-Amino-2-(methylthio)pyrimidine-4-carboxylic acid; 5-Amino-2-(methylsulfanyl)pyrimidine-4-carboxylic acid |
| Molecular Formula | C6H7N3O2S |
| Molecular Weight | 185.204 |
| Density | 1.5±0.1 g/cm3 |
| Boiling Point | 435.0±30.0 °C at 760 mmHg |
| Melting Point | 190-191.5℃ (decomposition) |
| Storage Condition | room temperature, dry |
| HTC | 2933599090 |
| PubChem ID | 37256659 |
| SMILES | CSc1ncc(N)c(C(=O)O)n1 |
| InChI | InChI=1S/C6H7N3O2S/c1-12-6-8-2-3(7)4(9-6)5(10)11/h2H,7H2,1H3,(H,10,11) |
| InChI Key | NTEPDMJNOBYJHJ-UHFFFAOYSA-N |
| MSDS | msds/72553_1_100130_05_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:C6H7N3O2S Molecular weight:185.2 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, sulfur 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 2933599090 Synthetic Route Total: 1 Page 5-Bromo-2-(meth... CAS#:50593-92-5 Copper sulfate ... CAS#:7758-99-8 5-Amino-2-(meth... CAS#:100130-05-0 Literature: US5977102 A1, ; US 5977102 A 5-Bromo-2-(meth... CAS#:50593-92-5 5-Amino-2-(meth... CAS#:100130-05-0 Literature: Canadian Journal of Chemistry, , vol. 34, p. 1444 Precursor & DownStream Precursor 2 CAS#:50593-92-5 5-Bromo-2-(meth... CAS#:7758-99-8 Copper sulfate ... DownStream 1 CAS#:98550-19-7 6-(Methylthio)p... |
| 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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