4-BENZYL-5-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL (CAS 91129-84-9) — formula C10H11N3S, molecular weight 205.28; category organic chemicals.
| CAS Number | 91129-84-9 |
|---|---|
| Molecular Formula | C10H11N3S |
| Molecular Weight | 205.28 |
| LogP | 1.5 |
| Category | Organic Chemicals |
4-BENZYL-5-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL is a carbon-based organic compound with CAS registry number 91129-84-9 and molecular formula C10H11N3S (molecular weight 205.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91129-84-9
Its molecular formula C10H11N3S comprises 10 C, 11 H, 3 N, 1 S atoms.
Also known as: 4-BENZYL-5-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL · 4-苄基-5-甲基-4H-[1,2,4]三唑-3-硫醇
Category: organic chemicals
The CAS registry number of 4-BENZYL-5-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL is 91129-84-9.
Molecular formula C10H11N3S, molecular weight 205.28.
It is also registered under: 4-BENZYL-5-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL, 4-苄基-5-甲基-4H-[1,2,4]三唑-3-硫醇.
Category: Organic Chemicals.
Independent reference data for 4-BENZYL-5-METHYL-4H-[1,2,4]TRIAZOLE-3-THIOL (CAS 91129-84-9), compiled from public chemistry databases.
| CAS 号 | 91129-84-9 |
|---|---|
| PubChem CID | 723293 |
| 分子式 | C10H11N3S |
| IUPAC 名称 | 4-benzyl-3-methyl-1H-1,2,4-triazole-5-thione |
| UNII（FDA） | HMS1783C05 |
| Molecular Weight | 205.28 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 205.06736854 |
| Monoisotopic Mass | 205.06736854 |
| Topological Polar Surface Area | 59.7 |
| Heavy Atom Count | 14 |
4-Benzyl-5-methyl-4H-1,2,4-triazole-3-thiol; RefChem:518479; 819-987-1; 91129-84-9; 4-benzyl-5-methyl-4h-[1,2,4]triazole-3-thiol; 4-benzyl-3-methyl-1H-1,2,4-triazole-5-thione; 4H-1,2,4-triazole-3-thiol, 5-methyl-4-(phenylmethyl)-; 4-benzyl-5-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione; 5-methyl-4-benzyl-1,2,4-triazole-3-thiol; MFCD02612745; 4-Benzyl-5-methyl-4H-1,2,4-triazol-3-thiol; MLS000516673; CHEMBL1299224; SCHEMBL10480363; DTXSID00352334; KPEVOVMFLHPYIS-UHFFFAOYSA-N
| 已通报的危害声明 | H302 (100%), H312 (100%), H318 (100%), H332 (100%) |
|---|
4-苄基-5-甲基-4H-[1,2,4]三唑-3-硫醇 · CAS 91129-84-9 · C10H11N3S. UNII HMS1783C05.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.