4-Chloro-7-(phenylsulfonyl)-7H-pyrrolo-[2,3-d]pyrimidine-6-carboxylic acid
4-Chloro-7-(phenylsulfonyl)-7H-pyrrolo-[2,3-d]pyrimidine-6-carboxylic acid
英文名称:4-Chloro-7-(phenylsulfonyl)-7H-pyrrolo-[2,3-d]pyrimidine-6-carboxylic acid
CAS号:1346447-16-2
分子式:C13H8ClN3O4S
分子量:337.74
EINECS号:
Mol文件:1346447-16-2.mol
4-Chloro-7-(phenylsulfonyl)-7H-pyrrolo-[2,3-d]pyrimidine-6-carboxylic acid 性质
| 沸点 | 622.2±65.0 °C(Predicted) |
|---|---|
| 密度 | 1.68±0.1 g/cm3(Predicted) |
| 形态 | solid |
| 酸度系数(pKa) | 2.68±0.30(Predicted) |
| InChI | 1S/C13H8ClN3O4S/c14-11-9-6-10(13(18)19)17(12(9)16-7-15-11)22(20,21)8-4-2-1-3-5-8/h1-7H,(H,18,19) |
| InChIKey | IRHIFBDAGLUAEB-UHFFFAOYSA-N |
| SMILES | OC(=O)c1cc2c(Cl)ncnc2n1S(=O)(=O)c3ccccc3 |
"4-Chloro-7-(phenylsulfonyl)-7H-pyrrolo-[2,3-d]pyrimidine-6-carboxylic acid"相关产品信息
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