1-(4'-磺基苯基)-3-羧基-5-吡唑啉酮(CAS 118-47-8):分子式 C10H8N2O6S、分子量 284.25。
| CAS号 | 118-47-8 |
|---|---|
| 分子式 | C10H8N2O6S |
| 分子量 | 284.25 |
| LogP | -0.3 |
| 应用领域 | General Manufacturing Information: 1H-Pyrazole-3-carboxylic acid、4、5-dihydro-5-oxo-1-(4-sulfophenyl)-: ACTIVE、1H-Pyrazole-3-carboxylic acid、5-hydroxy-1-(4-sulfophenyl)-: INACTIVE |
登记用途:General Manufacturing Information: 1H-Pyrazole-3-carboxylic acid、4、5-dihydro-5-oxo-1-(4-sulfophenyl)-: ACTIVE、1H-Pyrazole-3-carboxylic acid、5-hydroxy-1-(4-sulfophenyl)-: INACTIVE。
1-(4'-磺基苯基)-3-羧基-5-吡唑啉酮 是一种化工化合物,登记 CAS 号为 118-47-8,分子式 C10H8N2O6S(分子量 284.25)。
登记 CAS 号:118-47-8
其分子式 C10H8N2O6S 由 10 个碳、8 个氢、2 个氮、6 个氧、1 个硫 组成。
别名/同义词:1-(4'-磺基苯基)-3-羧基-5-吡唑啉酮 · 5-oxo-1-(4-sulphophenyl)-2-pyrazoline-3-carboxylic acid · 1-(4'-Sulfophenyl)-3-Carboxy-5-Pyrazolone
1-(4'-磺基苯基)-3-羧基-5-吡唑啉酮 的 CAS 登记号为 118-47-8。
分子式 C10H8N2O6S,分子量 284.25。
别名/同义词:1-(4'-磺基苯基)-3-羧基-5-吡唑啉酮、5-oxo-1-(4-sulphophenyl)-2-pyrazoline-3-carboxylic acid、1-(4'-Sulfophenyl)-3-Carboxy-5-Pyrazolone。
登记用途:General Manufacturing Information: 1H-Pyrazole-3-carboxylic acid、4、5-dihydro-5-oxo-1-(4-sulfophenyl)-: ACTIVE、1H-Pyrazole-3-carboxylic acid、5-hydroxy-1-(4-sulfophenyl)-: INACTIVE。
1-(4'-磺基苯基)-3-羧基-5-吡唑啉酮(CAS 118-47-8)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 118-47-8 |
|---|---|
| PubChem CID | 67045 |
| Molecular formula | C10H8N2O6S |
| IUPAC name | 5-oxo-1-(4-sulfophenyl)-4H-pyrazole-3-carboxylic acid |
| UNII (FDA) | 2A9HS5E9L7 |
| Molecular Weight | 284.25 |
|---|---|
| XLogP3 | -0.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 284.01030715 |
| Monoisotopic Mass | 284.01030715 |
| Topological Polar Surface Area | 133 |
| Heavy Atom Count | 19 |
118-47-8; Pyrazolone T; 1-(4'-SULFOPHENYL)-3-CARBOXY-5-PYRAZOLONE; 5-oxo-1-(4-sulfophenyl)-4H-pyrazole-3-carboxylic acid; 1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-; DTXSID5041273; EINECS 204-254-5; NSC 50665; BRN 0689305; 2A9HS5E9L7; 5-Oxo-1-(4-sulphophenyl)-2-pyrazoline-3-carboxylic acid; DTXCID3021273; NSC-50665; NSC-51118; RefChem:870517; DTXCID3036575
| GHS notification summary | 6.5% (10 / 154) |
|---|
| GHS notification summary | 6.5% (10 / 154) |
|---|---|
| Reported hazard statements | H319 (26%), H412 (67.5%) |
This chemical does not meet GHS hazard criteria for 6.5% (10 of 154) of reports.
H319 (26%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
1-(4'-Sulfophenyl)-3-Carboxy-5-Pyrazolone · CAS 118-47-8 · C10H8N2O6S. UNII 2A9HS5E9L7.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 5-oxo-1-(4-sulphophenyl)-2-pyrazoline-3-carboxylic acid