S-[4-(acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl] ethanethioate (CAS 82049-48-7) — formula C7H10N4O2S, molecular weight 214.25; category organic chemicals.
| CAS Number | 82049-48-7 |
|---|---|
| Molecular Formula | C7H10N4O2S |
| Molecular Weight | 214.25 |
| LogP | 0.1 |
| Category | Organic Chemicals |
S-[4-(acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl] ethanethioate is a carbon-based organic compound with CAS registry number 82049-48-7 and molecular formula C7H10N4O2S (molecular weight 214.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 82049-48-7
Its molecular formula C7H10N4O2S comprises 7 C, 10 H, 4 N, 2 O, 1 S atoms.
Also known as: S-[4-(acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl] ethanethioate · S-[4-(乙酰氨基)-5-甲基-4H-1,2,4-三唑-3-基]硫代乙酯
Category: organic chemicals
The CAS registry number of S-[4-(acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl] ethanethioate is 82049-48-7.
Molecular formula C7H10N4O2S, molecular weight 214.25.
It is also registered under: S-[4-(acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl] ethanethioate, S-[4-(乙酰氨基)-5-甲基-4H-1,2,4-三唑-3-基]硫代乙酯.
Category: Organic Chemicals.
Independent reference data for S-[4-(acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl] ethanethioate (CAS 82049-48-7), compiled from public chemistry databases.
| CAS 号 | 82049-48-7 |
|---|---|
| PubChem CID | 16205352 |
| 分子式 | C7H10N4O2S |
| IUPAC 名称 | S-(4-acetamido-5-methyl-1,2,4-triazol-3-yl) ethanethioate |
| UNII（FDA） | NS00060322 |
| Molecular Weight | 214.25 |
|---|---|
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 214.05244675 |
| Monoisotopic Mass | 214.05244675 |
| Topological Polar Surface Area | 102 |
| Heavy Atom Count | 14 |
82049-48-7; EINECS 279-894-1; S-(4-(Acetylamino)-5-methyl-4H-1,2,4-triazol-3-yl) ethanethioate; S-[4-(ACETYLAMINO)-5-METHYL-4H-1,2,4-TRIAZOL-3-YL] ETHANETHIOATE; RefChem:180547; 279-894-1; PYDSMPVYGIXTGX-UHFFFAOYSA-N; DTXSID501002422; NS00060322; N-[3-(Acetylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]ethanimidic acid
S-[4-(乙酰氨基)-5-甲基-4H-1,2,4-三唑-3-基]硫代乙酯 · CAS 82049-48-7 · C7H10N4O2S. UNII NS00060322.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.