5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL (CAS 21358-13-4) — formula C15H13N3OS, molecular weight 283.4; category organic chemicals.
| CAS Number | 21358-13-4 |
|---|---|
| Molecular Formula | C15H13N3OS |
| Molecular Weight | 283.4 |
| LogP | 3.2 |
| Category | Organic Chemicals |
5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL is a carbon-based organic compound with CAS registry number 21358-13-4 and molecular formula C15H13N3OS (molecular weight 283.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 21358-13-4
Its molecular formula C15H13N3OS comprises 15 C, 13 H, 3 N, 1 O, 1 S atoms.
Also known as: 5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL · 5-(苯氧基甲基)-4-苯基-4H-1,2,4-三唑-3-硫醇
Category: organic chemicals
The CAS registry number of 5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL is 21358-13-4.
Molecular formula C15H13N3OS, molecular weight 283.4.
It is also registered under: 5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL, 5-(苯氧基甲基)-4-苯基-4H-1,2,4-三唑-3-硫醇.
Category: Organic Chemicals.
Independent reference data for 5-PHENOXYMETHYL-4-PHENYL-4H-[1,2,4]TRIAZOLE-3-THIOL (CAS 21358-13-4), compiled from public chemistry databases.
| CAS 号 | 21358-13-4 |
|---|---|
| PubChem CID | 720920 |
| 分子式 | C15H13N3OS |
| IUPAC 名称 | 3-(phenoxymethyl)-4-phenyl-1H-1,2,4-triazole-5-thione |
| UNII（FDA） | HMS2587O04 |
| Molecular Weight | 283.4 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 283.07793322 |
| Monoisotopic Mass | 283.07793322 |
| Topological Polar Surface Area | 69 |
| Heavy Atom Count | 20 |
21358-13-4; 2,4-Dihydro-5-(phenoxymethyl)-4-phenyl-3H-1,2,4-triazole-3-thione; RefChem:246470; 5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazole-3-thiol; 5-Phenoxymethyl-4-phenyl-4H-[1,2,4]triazole-3-thiol; MFCD00619001; 3-(phenoxymethyl)-4-phenyl-1H-1,2,4-triazole-5-thione; CHEMBL1379971; 5-(phenoxymethyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione; 4-phenyl-5-(phenoxymethyl)-1,2,4-triazole-3-thiol; SCHEMBL5432352; SCHEMBL11887412; DTXSID30352185; HMS2587O04; ALBB-008850; BDBM50424848
5-(苯氧基甲基)-4-苯基-4H-1,2,4-三唑-3-硫醇 · CAS 21358-13-4 · C15H13N3OS. UNII HMS2587O04.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.