5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine (CAS 72836-11-4) — formula C9H8N4O2S2, molecular weight 268.3; category organic chemicals.
| CAS Number | 72836-11-4 |
|---|---|
| Molecular Formula | C9H8N4O2S2 |
| Molecular Weight | 268.3 |
| LogP | 2.2 |
| Category | Organic Chemicals |
5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine is a carbon-based organic compound with CAS registry number 72836-11-4 and molecular formula C9H8N4O2S2 (molecular weight 268.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72836-11-4
Its molecular formula C9H8N4O2S2 comprises 9 C, 8 H, 4 N, 2 O, 2 S atoms.
Also known as: 5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine · 5-{[(4-硝基苯基)甲基]硫基}-1,3,4-噻二唑-2-胺
Category: organic chemicals
The CAS registry number of 5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine is 72836-11-4.
Molecular formula C9H8N4O2S2, molecular weight 268.3.
It is also registered under: 5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine, 5-{[(4-硝基苯基)甲基]硫基}-1,3,4-噻二唑-2-胺.
Category: Organic Chemicals.
Independent reference data for 5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine (CAS 72836-11-4), compiled from public chemistry databases.
| CAS 号 | 72836-11-4 |
|---|---|
| PubChem CID | 351888 |
| 分子式 | C9H8N4O2S2 |
| IUPAC 名称 | 5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine |
| UNII（FDA） | HMS2609N04 |
| Molecular Weight | 268.3 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 268.00886786 |
| Monoisotopic Mass | 268.00886786 |
| Topological Polar Surface Area | 151 |
| Heavy Atom Count | 17 |
72836-11-4; 5-(((4-Nitrophenyl)methyl)thio)-1,3,4-thiadiazol-2-amine; 5-[[(4-Nitrophenyl)methyl]thio]-1,3,4-thiadiazol-2-amine; RefChem:299024; 5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine; CHEMBL174487; 5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine; NSC 523934; 5-((4-nitrobenzyl)thio)-1,3,4-thiadiazol-2-amine; 5-[(4-nitrobenzyl)thio]-1,3,4-thiadiazol-2-amine; NSC523934; CBMicro_006506; Cambridge id 5806840; Oprea1_092108; Oprea1_686406; MLS000693171
5-{[(4-硝基苯基)甲基]硫基}-1,3,4-噻二唑-2-胺 · CAS 72836-11-4 · C9H8N4O2S2. UNII HMS2609N04.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.