Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
Methyl 6-methylpyridine-2-carboxylate
Methyl 6-methylpicolinate · NSC 109151 · 6-Methylpicolinic Acid Methyl Ester · Methyl-6-methylpyridin-2-carboxylat · methyl 6-methylpyridine-2-carboxylate · METHYL-6-MENTHYPYRIDINE-2-CARBOXYLATE · Methyl 6-methyl-2-pyridinecarboxylate · Methyl6-Methylpyridine-2-carboxylate>Methyl6-methylpyridine-2-carboxylate,96%
식별자 및 물리적 특성
| CAS No. | 13602-11-4 |
|---|---|
| 분자식 | C8H9NO2 |
| 평균 분자량 | 151.16 g/mol |
| 단동위원소 질량 | 151.06332853 g/mol |
| SMILES | COC(=O)c1cccc(C)n1 |
| InChIKey | CYWIZMOZBTXFIL-UHFFFAOYSA-N |
| PubChem CID | 73022 |
| EC No. | 237-085-0 |
| DTXSID | DTXSID90159632 |
화학 및 물리적 성질
| XLogP | 1.4 |
|---|---|
| 극성 표면적 | 39.2 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 3 |
| 회전 가능 결합 수 | 2 |
| 무거운 원자 수 | 11 |
| 형식 전하 | 0 |
| 복잡도 | 147 |
| 녹는점 | 18 °C |
| 끓는 점 | 242℃ |
| 밀도 | 1.104 |
| 굴절률 | 1.5160-1.5200 |
| 인화점 | 100℃ |
| 저장 조건 | Inert atmosphere,Room Temperature |
| 물리적 상태 | powder to lump to clear liquid |
| pKa(산도 계수) | 1.93±0.10(Predicted) |
| 색상 | White or Colorless to Light yellow |
안전 및 규제
| GHS 분류 | WarningH302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (25%) |
| 관세 코드 | 2933399990 |
용도
용도
Methyl 6-Methylpyridine-2-carboxylate is a reagent used in the sunthesis of antitumor agents based upon the dihydropyrrolopyrazole compounds. Also used in the synthesis of quinazolinone TGF-β inhibitors.