3H-1,2,4-Triazol-3-one,1,2-dihydro-1-(1-methylethyl)-5-(methylthio)-(9CI) (CAS 42838-38-0) — formula C6H11N3OS, molecular weight 173.24; category organic chemicals.
| CAS Number | 42838-38-0 |
|---|---|
| Molecular Formula | C6H11N3OS |
| Molecular Weight | 173.24 |
| LogP | 1.1 |
| Category | Organic Chemicals |
3H-1,2,4-Triazol-3-one,1,2-dihydro-1-(1-methylethyl)-5-(methylthio)-(9CI) is a carbon-based organic compound with CAS registry number 42838-38-0 and molecular formula C6H11N3OS (molecular weight 173.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 42838-38-0
Its molecular formula C6H11N3OS comprises 6 C, 11 H, 3 N, 1 O, 1 S atoms.
Also known as: 3H-1,2,4-Triazol-3-one,1,2-dihydro-1-(1-methylethyl)-5-(methylthio)-(9CI) · 3H-1,2,4-三唑-3-酮,1,2-二氢-1-(1-甲基乙基)-5-(甲硫基)-(9Cl)
Category: organic chemicals
The CAS registry number of 3H-1,2,4-Triazol-3-one,1,2-dihydro-1-(1-methylethyl)-5-(methylthio)-(9CI) is 42838-38-0.
Molecular formula C6H11N3OS, molecular weight 173.24.
It is also registered under: 3H-1,2,4-Triazol-3-one,1,2-dihydro-1-(1-methylethyl)-5-(methylthio)-(9CI), 3H-1,2,4-三唑-3-酮,1,2-二氢-1-(1-甲基乙基)-5-(甲硫基)-(9Cl).
Category: Organic Chemicals.
Independent reference data for 3H-1,2,4-Triazol-3-one,1,2-dihydro-1-(1-methylethyl)-5-(methylthio)-(9CI) (CAS 42838-38-0), compiled from public chemistry databases.
| CAS 号 | 42838-38-0 |
|---|---|
| PubChem CID | 20367171 |
| 分子式 | C6H11N3OS |
| IUPAC 名称 | 3-methylsulfanyl-2-propan-2-yl-1H-1,2,4-triazol-5-one |
| Molecular Weight | 173.24 |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 173.06228316 |
| Monoisotopic Mass | 173.06228316 |
| Topological Polar Surface Area | 70 |
| Heavy Atom Count | 11 |
SCHEMBL11605902; GPLIEVZOSLZRMR-UHFFFAOYSA-N; 42838-38-0; DB-283035; 1-isopropyl-5-methylthio-3-hydroxy-1,2,4-triazole; 1-Isopropyl-5-methylmercapto-3-hydroxy-1,2,4-triazole; 3H-1,2,4-TRIAZOL-3-ONE, 1,2-DIHYDRO-1-(1-METHYLETHYL)-5-(METHYLTHIO)-
3H-1,2,4-三唑-3-酮,1,2-二氢-1-(1-甲基乙基)-5-(甲硫基)-(9Cl) · CAS 42838-38-0 · C6H11N3OS.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.