4-ALLYL-5-PYRIDIN-2-YL-4H-1,2,4-TRIAZOLE-3-THIOL (CAS 91813-63-7) — formula C10H10N4S, molecular weight 218.28; category organic chemicals.
| CAS Number | 91813-63-7 |
|---|---|
| Molecular Formula | C10H10N4S |
| Molecular Weight | 218.28 |
| LogP | 1.5 |
| Category | Organic Chemicals |
4-ALLYL-5-PYRIDIN-2-YL-4H-1,2,4-TRIAZOLE-3-THIOL is a carbon-based organic compound with CAS registry number 91813-63-7 and molecular formula C10H10N4S (molecular weight 218.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91813-63-7
Its molecular formula C10H10N4S comprises 10 C, 10 H, 4 N, 1 S atoms.
Also known as: 4-ALLYL-5-PYRIDIN-2-YL-4H-1,2,4-TRIAZOLE-3-THIOL · 3H-1,2,4-三唑-3-硫酮,2,4-二氢-4-烯丙基-5-(2-吡啶基)-
Category: organic chemicals
The CAS registry number of 4-ALLYL-5-PYRIDIN-2-YL-4H-1,2,4-TRIAZOLE-3-THIOL is 91813-63-7.
Molecular formula C10H10N4S, molecular weight 218.28.
It is also registered under: 4-ALLYL-5-PYRIDIN-2-YL-4H-1,2,4-TRIAZOLE-3-THIOL, 3H-1,2,4-三唑-3-硫酮,2,4-二氢-4-烯丙基-5-(2-吡啶基)-.
Category: Organic Chemicals.
Independent reference data for 4-ALLYL-5-PYRIDIN-2-YL-4H-1,2,4-TRIAZOLE-3-THIOL (CAS 91813-63-7), compiled from public chemistry databases.
| CAS 号 | 91813-63-7 |
|---|---|
| PubChem CID | 2780186 |
| 分子式 | C10H10N4S |
| IUPAC 名称 | 4-prop-2-enyl-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione |
| UNII（FDA） | ST50213631 |
| Molecular Weight | 218.28 |
|---|---|
| XLogP3 | 1.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 218.06261751 |
| Monoisotopic Mass | 218.06261751 |
| Topological Polar Surface Area | 72.6 |
| Heavy Atom Count | 15 |
91813-63-7; 4-allyl-5-pyridin-2-yl-4H-1,2,4-triazole-3-thiol; 4-ALLYL-3-(2-PYRIDYL)-4,5-DIHYDRO-1H-1,2,4-TRIAZOLE-5-THIONE; 4-prop-2-enyl-3-pyridin-2-yl-1H-1,2,4-triazole-5-thione; 4-Allyl-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol; MFCD00099436; NSC609095; MLS003373914; 4-(prop-2-en-1-yl)-5-(pyridin-2-yl)-4H-1,2,4-triazole-3-thiol; 4-(prop-2-en-1-yl)-3-(pyridin-2-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione; 4-prop-2-enyl-5-(2-pyridyl)-1,2,4-triazole-3-thiol; CHEMBL2143171; DTXSID30381637; GQUMJEVEIZJHNE-UHFFFAOYSA-N; ALBB-003361; BBL013351
| 已通报的危害声明 | H302 (100%), H312 (100%), H315 (100%), H318 (100%), H332 (100%), H335 (100%) |
|---|
3H-1,2,4-三唑-3-硫酮,2,4-二氢-4-烯丙基-5-(2-吡啶基)- · CAS 91813-63-7 · C10H10N4S. UNII ST50213631.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.