Methyl (S)-2-(1H-indazole-3-carboxamido)-3,3-dimethylbutanoate
한글명:Methyl (S)-2-(1H-indazole-3-carboxamido)-3,3-dimethylbutanoate
카스 번호2709672-58-0
상품명:Methyl (S)-2-(1H-indazole-3-carboxamido)-3,3-dimethylbutanoate
CBNumberCB210987337
분자식C15H19N3O3
포뮬러 무게289.34
MOL 파일2709672-58-0.mol
화학적 성질
| 끓는 점 | 523.1±30.0 °C(Predicted) |
| 밀도 | 1.213±0.06 g/cm3(Predicted) |
| 용해도 | DMF: 12.5 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 10 mg/ml; Ethanol: 3 mg/ml |
| 물리적 상태 | 결정성 고체 |
| 산도 계수 (pKa) | 11.72±0.46(Predicted) |
| InChI | InChI=1/C15H19N3O3/c1-15(2,3)12(14(20)21-4)16-13(19)11-9-7-5-6-8-10(9)17-18-11/h5-8,12H,1-4H3,(H,16,19)(H,17,18)/t12-/s3 |
| InChIKey | QEXPVGIGOZJEOO-PLAQIDKDNA-N |
| SMILES | C(C1=NNC2=CC=CC=C12)(=O)N[C@@H](C(C)(C)C)C(=O)OC |&1:12,r| |
