4-ALLYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOLE-3-THIOL (CAS 21358-15-6) — formula C12H13N3OS, molecular weight 247.32; category organic chemicals.
| CAS Number | 21358-15-6 |
|---|---|
| Molecular Formula | C12H13N3OS |
| Molecular Weight | 247.32 |
| LogP | 2.3 |
| Category | Organic Chemicals |
4-ALLYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOLE-3-THIOL is a carbon-based organic compound with CAS registry number 21358-15-6 and molecular formula C12H13N3OS (molecular weight 247.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 21358-15-6
Its molecular formula C12H13N3OS comprises 12 C, 13 H, 3 N, 1 O, 1 S atoms.
Also known as: 4-ALLYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOLE-3-THIOL · 4-烯丙基-5-苯氧基甲基-4H-[1,2,4]三唑-3-硫醇
Category: organic chemicals
The CAS registry number of 4-ALLYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOLE-3-THIOL is 21358-15-6.
Molecular formula C12H13N3OS, molecular weight 247.32.
It is also registered under: 4-ALLYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOLE-3-THIOL, 4-烯丙基-5-苯氧基甲基-4H-[1,2,4]三唑-3-硫醇.
Category: Organic Chemicals.
Independent reference data for 4-ALLYL-5-(PHENOXYMETHYL)-4H-1,2,4-TRIAZOLE-3-THIOL (CAS 21358-15-6), compiled from public chemistry databases.
| CAS 号 | 21358-15-6 |
|---|---|
| PubChem CID | 720960 |
| 分子式 | C12H13N3OS |
| IUPAC 名称 | 3-(phenoxymethyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione |
| UNII（FDA） | HMS1536H08 |
| Molecular Weight | 247.32 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 247.07793322 |
| Monoisotopic Mass | 247.07793322 |
| Topological Polar Surface Area | 69 |
| Heavy Atom Count | 17 |
21358-15-6; 4-allyl-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol; DTXSID80352190; RefChem:289692; DTXCID50303255; 4-Allyl-5-phenoxymethyl-4H-[1,2,4]triazole-3-thiol; 5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol; MFCD00618999; 3-(phenoxymethyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione; 5-(phenoxymethyl)-4-prop-2-enyl-1,2,4-triazole-3-thiol; 4-ALLYL-5-PHENOXYMETHYL-4H-(1,2,4)TRIAZOLE-3-THIOL; TimTec1_000866; Oprea1_737867; Oprea1_758208; SCHEMBL10013032; HMS1536H08
4-烯丙基-5-苯氧基甲基-4H-[1,2,4]三唑-3-硫醇 · CAS 21358-15-6 · C12H13N3OS. UNII HMS1536H08.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.