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1,2-Cyclopentanediol, 3-[7-aMino-5-(propylthio)-3H-1,2,3-triazolo[4,5-d]pyriMidin-3-yl]-5-(2-hydroxyethoxy)-, (1S,2S,3R,5S)-
化学名:1,2-Cyclopentanediol, 3-[7-aMino-5-(propylthio)-3H-1,2,3-triazolo[4,5-d]pyriMidin-3-yl]-5-(2-hydroxyethoxy)-, (1S,2S,3R,5S)-
CAS番号.1251765-07-7
英語名:1,2-Cyclopentanediol, 3-[7-aMino-5-(propylthio)-3H-1,2,3-triazolo[4,5-d]pyriMidin-3-yl]-5-(2-hydroxyethoxy)-, (1S,2S,3R,5S)-
CBNumberCB12667947
MFC14H22N6O4S
MW370.43
MOL File1251765-07-7.mol
1,2-Cyclopentanediol, 3-[7-aMino-5-(propylthio)-3H-1,2,3-triazolo[4,5-d]pyriMidin-3-yl]-5-(2-hydroxyethoxy)-, (1S,2S,3R,5S)-物理性質
沸点 | 711.4±70.0 °C(Predicted) |
比重(密度) | 1.75±0.1 g/cm3(Predicted) |
溶解性 | DMSO (Slightly), Methanol (Slightly, Heated) |
外見 | Solid |
酸解離定数(Pka) | 13.26±0.70(Predicted) |
色 | White to Off-White |
安定性: | Hygroscopic |
InChI | InChI=1S/C14H22N6O4S/c1-2-5-25-14-16-12(15)9-13(17-14)20(19-18-9)7-6-8(24-4-3-21)11(23)10(7)22/h7-8,10-11,21-23H,2-6H2,1H3,(H2,15,16,17)/t7-,8+,10+,11-/m1/s1 |
InChIKey | YTYBSYIHUFBLKV-YKDSUIRESA-N |
SMILES | [C@@H]1(O)[C@@H](OCCO)C[C@@H](N2C3C(N=N2)=C(N)N=C(SCCC)N=3)[C@@H]1O |
CAS データベース | 1251765-07-7 |