1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate (CAS 3414-96-8) — formula C8H7N3OS, molecular weight 193.23; category organic chemicals.
| CAS Number | 3414-96-8 |
|---|---|
| Molecular Formula | C8H7N3OS |
| Molecular Weight | 193.23 |
| LogP | 1.5 |
| Category | Organic Chemicals |
1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate is a carbon-based organic compound with CAS registry number 3414-96-8 and molecular formula C8H7N3OS (molecular weight 193.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3414-96-8
Its molecular formula C8H7N3OS comprises 8 C, 7 H, 3 N, 1 O, 1 S atoms.
Also known as: 1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate · 1H-1,2,4-三唑-3-硫醇，5-(对羟基苯基)-，水合物
Category: organic chemicals
The CAS registry number of 1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate is 3414-96-8.
Molecular formula C8H7N3OS, molecular weight 193.23.
It is also registered under: 1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate, 1H-1,2,4-三唑-3-硫醇，5-(对羟基苯基)-，水合物.
Category: Organic Chemicals.
Independent reference data for 1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate (CAS 3414-96-8), compiled from public chemistry databases.
| CAS 号 | 3414-96-8 |
|---|---|
| PubChem CID | 689100 |
| 分子式 | C8H7N3OS |
| IUPAC 名称 | 5-(4-hydroxyphenyl)-1,2-dihydro-1,2,4-triazole-3-thione |
| UNII（FDA） | HMS2278E24 |
| Molecular Weight | 193.23 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 193.03098303 |
| Monoisotopic Mass | 193.03098303 |
| Topological Polar Surface Area | 88.7 |
| Heavy Atom Count | 13 |
3414-96-8; RefChem:1052271; 1,2-Dihydro-5-(4-hydroxyphenyl)-3H-1,2,4-triazole-3-thione; 4-(5-sulfanyl-4H-1,2,4-triazol-3-yl)phenol; 4-(5-mercapto-4H-1,2,4-triazol-3-yl)phenol; NSC625816; MLS000547905; 5-(p-Hydroxyphenyl)-1H-1,2,4-triazole-3-thiol hydrate; 5-(4-hydroxyphenyl)-1,2-dihydro-1,2,4-triazole-3-thione; 1H-1,2,4-Triazole-3-thiol, 5-(p-hydroxyphenyl)-, hydrate; Phenol, 4-(3-mercapto-5-(1H-1,2,4-triazolyl))-, hydrate; SMR000113306; MFCD01930057; 4-(5-sulfanylidene-1,2,4-triazolidin-3-ylidene)cyclohexa-2,5-dien-1-one; SCHEMBL3987498; CHEMBL1329322
1H-1,2,4-三唑-3-硫醇，5-(对羟基苯基)-，水合物 · CAS 3414-96-8 · C8H7N3OS. UNII HMS2278E24.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.