3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid (CAS 6345-16-0) — formula C12H13NO4S2, molecular weight 299.4; category organic chemicals.
3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid is a carbon-based organic compound with CAS registry number 6345-16-0 and molecular formula C12H13NO4S2 (molecular weight 299.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6345-16-0
Its molecular formula C12H13NO4S2 comprises 12 C, 13 H, 1 N, 4 O, 2 S atoms.
Also known as: 3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid · 3-[2-(3-硝基苯基)-1,3-二硫杂环戊烷-2-基]丙酸
Category: organic chemicals
The CAS registry number of 3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid is 6345-16-0.
Molecular formula C12H13NO4S2, molecular weight 299.4.
It is also registered under: 3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid, 3-[2-(3-硝基苯基)-1,3-二硫杂环戊烷-2-基]丙酸.
Category: Organic Chemicals.
Public-database records for 3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid (CAS 6345-16-0), reproduced here for independent cross-checking.
| CAS 号 | 6345-16-0 |
|---|---|
| PubChem CID | 242649 |
| 分子式 | C12H13NO4S2 |
| IUPAC 名称 | 3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid |
6345-16-0; 3-[2-(3-nitrophenyl)-1,3-dithiolan-2-yl]propanoic acid; NSC51450; DTXSID70287528; NSC-51450
| 分子量 | 299.4 |
|---|---|
| XLogP3 | 2.4 |
| 氢键供体数 | 1 |
| 氢键受体数 | 6 |
| 可旋转键数 | 4 |
| 精确质量 | 299.02860024 |
| 单同位素质量 | 299.02860024 |
| 拓扑极性表面积 | 134 |
| 重原子数 | 19 |
| 形式电荷 | 0 |
3-[2-(3-硝基苯基)-1,3-二硫杂环戊烷-2-基]丙酸 · CAS 6345-16-0 · C12H13NO4S2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.