3-Phenyl-1,2,4-triazole-5-thiol hydrate (CAS 3414-94-6) — formula C8H7N3S, molecular weight 177.23; category organic chemicals.
| CAS Number | 3414-94-6 |
|---|---|
| Molecular Formula | C8H7N3S |
| Molecular Weight | 177.23 |
| LogP | 1.84 |
| Category | Organic Chemicals |
3-Phenyl-1,2,4-triazole-5-thiol hydrate is a carbon-based organic compound with CAS registry number 3414-94-6 and molecular formula C8H7N3S (molecular weight 177.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3414-94-6
Its molecular formula C8H7N3S comprises 8 C, 7 H, 3 N, 1 S atoms.
Also known as: 3-Phenyl-1,2,4-triazole-5-thiol hydrate · 3-苯基-1,2,4-三唑-5-硫醇水合物
Category: organic chemicals
The CAS registry number of 3-Phenyl-1,2,4-triazole-5-thiol hydrate is 3414-94-6.
Molecular formula C8H7N3S, molecular weight 177.23.
It is also registered under: 3-Phenyl-1,2,4-triazole-5-thiol hydrate, 3-苯基-1,2,4-三唑-5-硫醇水合物.
Category: Organic Chemicals.
Independent reference data for 3-Phenyl-1,2,4-triazole-5-thiol hydrate (CAS 3414-94-6), compiled from public chemistry databases.
| CAS Registry Number | 3414-94-6 |
|---|---|
| PubChem CID | 698268 |
| Molecular formula | C8H7N3S |
| IUPAC name | 5-phenyl-1,2-dihydro-1,2,4-triazole-3-thione |
| UNII (FDA) | V3LV9TS8XD |
| Molecular Weight | 177.23 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 177.03606841 |
| Monoisotopic Mass | 177.03606841 |
| Topological Polar Surface Area | 68.5 |
| Heavy Atom Count | 12 |
| LogP | 1.84 |
|---|
3414-94-6; 5-Phenyl-1H-1,2,4-triazole-3-thiol; 5-phenyl-4H-1,2,4-triazole-3-thiol; 5-Phenyl-s-triazole-3-thiol; 1H-1,2,4-TRIAZOLE-3-THIOL, 5-PHENYL-; V3LV9TS8XD; 3-Phenyl-1,2,4-triazole-5-thiol; NSC 11565; 5-Phenyl-2H-1,2,4-triazole-3-thiol; 1,4-Dihydro-5-phenyl-3H-1,2,4-triazole-3-thione; 3H-1,2,4-Triazole-3-thione, 1,2-dihydro-5-phenyl-; 2-Fenil-5-mercapto-1,3,4-triazolo [Italian]; NSC-11565; 2-Fenil-5-mercapto-1,3,4-triazolo; 3-Mercapto-5-phenyl-1,2,4-triazole; 3H-1,2,4-Triazole-3-thione, 1,4-dihydro-5-phenyl-
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3-Phenyl-1,2,4-triazole-5-thiol hydrate · CAS 3414-94-6 · C8H7N3S. UNII V3LV9TS8XD. LogP: 1.84.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-苯基-1,2,4-三唑-5-硫醇水合物