硫硫胺(CAS 299-35-4):分子式 C12H16N4OS2、分子量 296.4。
| CAS号 | 299-35-4 |
|---|---|
| 分子式 | C12H16N4OS2 |
| 分子量 | 296.4 |
| LogP | 0.8 |
硫硫胺 是一种化工化合物,登记 CAS 号为 299-35-4,分子式 C12H16N4OS2(分子量 296.4)。
登记 CAS 号:299-35-4
其分子式 C12H16N4OS2 由 12 个碳、16 个氢、4 个氮、1 个氧、2 个硫 组成。
别名/同义词:硫硫胺 · Thiothiamine
硫硫胺 的 CAS 登记号为 299-35-4。
分子式 C12H16N4OS2,分子量 296.4。
别名/同义词:硫硫胺、Thiothiamine。
硫硫胺(CAS 299-35-4)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 299-35-4 |
|---|---|
| PubChem CID | 67530 |
| Molecular formula | C12H16N4OS2 |
| IUPAC name | 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazole-2-thione |
| UNII (FDA) | J8QL0N8LM4 |
| Molecular Weight | 296.4 |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 296.07655349 |
| Monoisotopic Mass | 296.07655349 |
| Topological Polar Surface Area | 133 |
| Heavy Atom Count | 19 |
Thiothiamine; 299-35-4; Thioxothiamine; Thiothiamin; J8QL0N8LM4; Thiamin Thiothiazolone; 3-(4-Amino-2-methylpyrimidin-5-ylmethyl)-5-(2-hydroxyethyl)-4-methylthiazole-2(3H)-thione; DTXSID60184012; EINECS 206-077-9; THIOXOTHIAMINE [EP IMPURITY]; 3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4-methyl-2(3H)-thiazolethione; EC 206-077-9; THIAMINE NITRATE IMPURITY E [EP IMPURITY]; THIAMINE HYDROCHLORIDE IMPURITY E [EP IMPURITY]; THIOXOTHIAMINE (EP IMPURITY); 2(3H)-THIAZOLETHIONE, 3-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)-5-(2-HYDROXYETHYL)-4-METHYL-
| Reported hazard statements | H319 (100%) |
|---|
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Thiothiamine · CAS 299-35-4 · C12H16N4OS2. UNII J8QL0N8LM4.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: Thiothiamine