8-[(sec-Butyl)thio]-6,7-dihydro-1,3-dimethyl-6-thioxo-1H-purin-2(3H)-one (CAS 6493-40-9) — formula C11H16N4OS2, molecular weight 284.4; category organic chemicals.
| CAS Number | 6493-40-9 |
|---|---|
| Molecular Formula | C11H16N4OS2 |
| Molecular Weight | 284.4 |
| LogP | 2.4 |
| Category | Organic Chemicals |
8-[(sec-Butyl)thio]-6,7-dihydro-1,3-dimethyl-6-thioxo-1H-purin-2(3H)-one is a carbon-based organic compound with CAS registry number 6493-40-9 and molecular formula C11H16N4OS2 (molecular weight 284.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6493-40-9
Its molecular formula C11H16N4OS2 comprises 11 C, 16 H, 4 N, 1 O, 2 S atoms.
Also known as: 8-[(sec-Butyl)thio]-6,7-dihydro-1,3-dimethyl-6-thioxo-1H-purin-2(3H)-one · 8-[(仲丁基)硫基]-6,7-二氢-1,3-二甲基-6-硫代-1H-嘌呤-2(3H)-酮
Category: organic chemicals
The CAS registry number of 8-[(sec-Butyl)thio]-6,7-dihydro-1,3-dimethyl-6-thioxo-1H-purin-2(3H)-one is 6493-40-9.
Molecular formula C11H16N4OS2, molecular weight 284.4.
It is also registered under: 8-[(sec-Butyl)thio]-6,7-dihydro-1,3-dimethyl-6-thioxo-1H-purin-2(3H)-one, 8-[(仲丁基)硫基]-6,7-二氢-1,3-二甲基-6-硫代-1H-嘌呤-2(3H)-酮.
Category: Organic Chemicals.
Independent reference data for 8-[(sec-Butyl)thio]-6,7-dihydro-1,3-dimethyl-6-thioxo-1H-purin-2(3H)-one (CAS 6493-40-9), compiled from public chemistry databases.
| CAS 号 | 6493-40-9 |
|---|---|
| PubChem CID | 3034533 |
| 分子式 | C11H16N4OS2 |
| IUPAC 名称 | 8-butan-2-ylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one |
| Molecular Weight | 284.4 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 284.07655349 |
| Monoisotopic Mass | 284.07655349 |
| Topological Polar Surface Area | 110 |
| Heavy Atom Count | 18 |
Theophylline, 8-(sec-butylthio)-6-thio-; 6493-40-9; RefChem:1099797; 6-Thio-8-(1'-methylpropyl)thiotheophylline; NSC 95886; BRN 1133164; NSC95886; Uric acid, 8-(sec-butylthio)-1,3-dimethyl-6-thio-; NSC-95886
8-[(仲丁基)硫基]-6,7-二氢-1,3-二甲基-6-硫代-1H-嘌呤-2(3H)-酮 · CAS 6493-40-9 · C11H16N4OS2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.