Ethyl 6-bromo-5-hydroxy-1-methyl-2-(phenylsulfanylmethyl)indole-3-carboxylate
한글명:Ethyl 6-bromo-5-hydroxy-1-methyl-2-(phenylsulfanylmethyl)indole-3-carboxylate
카스 번호131707-24-9
상품명:Ethyl 6-bromo-5-hydroxy-1-methyl-2-(phenylsulfanylmethyl)indole-3-carboxylate
CBNumberCB81417913
분자식C19H18BrNO3S
포뮬러 무게420.32
MOL 파일131707-24-9.mol
화학적 성질
| 녹는점 | >192°C (dec.) |
| 끓는 점 | 570.6±50.0 °C(Predicted) |
| 밀도 | 1.44±0.1 g/cm3(Predicted) |
| 저장 조건 | under inert gas (nitrogen or Argon) at 2-8°C |
| 용해도 | DMSO(약간 용해됨), 메탄올(약간 용해됨, 가열) |
| 산도 계수 (pKa) | 7.60±0.40(Predicted) |
| 물리적 상태 | 고체 |
| 물리적 상태 | 단단한 모양 |
| 색상 | 흰색에서 밝은 갈색까지 |
| InChI | InChI=1S/C19H18BrNO3S/c1-3-24-19(23)18-13-9-17(22)14(20)10-15(13)21(2)16(18)11-25-12-7-5-4-6-8-12/h4-10,22H,3,11H2,1-2H3 |
| InChIKey | DAFNNZWQTJQQAP-UHFFFAOYSA-N |
| SMILES | N1(C)C2=C(C=C(O)C(Br)=C2)C(C(OCC)=O)=C1CSC1=CC=CC=C1 |
