2-(Methylsulfonyl)pyrimidine-5-carboxylic acid
化学名:2-(Methylsulfonyl)pyrimidine-5-carboxylic acid
CAS番号.914208-17-6
英語名:2-(Methylsulfonyl)pyrimidine-5-carboxylic acid
CBNumberCB2828811
MFC6H6N2O4S
MW202.19
MOL FileMol file
2-(Methylsulfonyl)pyrimidine-5-carboxylic acid物理性質
| 沸点 | 498.9±37.0 °C(Predicted) |
| 比重(密度) | 1.553±0.06 g/cm3(Predicted) |
| 貯蔵温度 | Storage temp. 2-8°C |
| 溶解性 | Aqueous Base (Slightly), DMSO (Slightly, Heated), Methanol (Slightly) |
| 外見 | Solid |
| 酸解離定数(Pka) | 2.04±0.10(Predicted) |
| 色 | White to Off-White |
| InChI | InChI=1S/C6H6N2O4S/c1-13(11,12)6-7-2-4(3-8-6)5(9)10/h2-3H,1H3,(H,9,10) |
| InChIKey | LNADHOIWAYQWPG-UHFFFAOYSA-N |
| SMILES | C1(S(C)(=O)=O)=NC=C(C(O)=O)C=N1 |