Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
3-메틸티오-1,2,4-트리아진
3-메틸티오-1,2,4-트리아진 · 3-(Methylthio)-as-Triazine · 3-METHYLTHIO-1,2,4-TRIAZINE · 3-(Methylthio)-2,4-triazine · 1,2,4-Triazine, 3-(Methylthio)- · 3-(Methylsulfanyl)-1,2,4-triazine · METHYL 1,2,4-TRIAZIN-3-YL SULFIDE · 3-Methylthio-1,2,4-triazine ISO 9001：2015 REACH
식별자 및 물리적 특성
| CAS No. | 28735-21-9 |
|---|---|
| 분자식 | C4H5N3S |
| 평균 분자량 | 127.172 g/mol |
| 단동위원소 질량 | 127.02041816 g/mol |
| SMILES | CSc1nccnn1 |
| InChIKey | NFHGWQLAJYTULJ-UHFFFAOYSA-N |
| PubChem CID | 321839 |
| EC No. | 824-121-0 |
| DTXSID | DTXSID80313726 |
| 현지명 | 3-메틸티오-1,2,4-트리아진 |
화학 및 물리적 성질
| 녹는점 | 33 °C |
|---|---|
| 끓는 점 | 275.8±23.0 °C(Predicted) |
| 밀도 | 1.28±0.1 g/cm3(Predicted) |
| 저장 조건 | Inert atmosphere,Room Temperature |
| 물리적 상태 | solid |
| pKa(산도 계수) | 1.32±0.63(Predicted) |
| InChI | InChI=1S/C4H5N3S/c1-8-4-5-2-3-6-7-4/h2-3H,1H3 |
| InChIKey | NFHGWQLAJYTULJ-UHFFFAOYSA-N |
| SMILES | N1C=CN=C(SC)N=1 |
안전 및 규제
| 수질 위해 등급(WGK) | WGK 3 |
|---|---|
| 관세 코드 | 2933698090 |
| 위험 문구(R) | 22 |
| 위험 표시 | Xn |
| 위험 등급 | Acute Tox. 4 Oral |
| 저장 분류 | 11 - Combustible Solids |
용도
용도
3-Methylthio-1,2,4-triazine has a phenyl ring and has been shown to be pde5 inhibitory. 3-Methylthio-1,2,4-triazine was treated with potassium amide in liquid ammonia to give 3-amino-1,2,4-triazine, 3,3′-bis(methylthio)-5,5′-bis-1,2,4-triazine and 3-amino-3′-(methylthio)-5,5′-bis-1,2,4-triazine. triazine, 3,3′-bis(methylthio)-5,5′-bis-1,2,4-triazine and 3-amino-3′-(methylthio)-5,5′-bis-1,2,4-triazine. It is also used in the preparation of pharmaceutical products.