6-thioxanthine (CAS 2002-59-7) — formula C5H4N4OS, molecular weight 168.18; category organic chemicals.
| CAS Number | 2002-59-7 |
|---|---|
| Molecular Formula | C5H4N4OS |
| Molecular Weight | 168.18 |
| LogP | -0.1 |
| Category | Organic Chemicals |
6-thioxanthine is a carbon-based organic compound with CAS registry number 2002-59-7 and molecular formula C5H4N4OS (molecular weight 168.18), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2002-59-7
Its molecular formula C5H4N4OS comprises 5 C, 4 H, 4 N, 1 O, 1 S atoms.
Also known as: 6-thioxanthine · 6-硫代黄嘌呤
Category: organic chemicals
The CAS registry number of 6-thioxanthine is 2002-59-7.
Molecular formula C5H4N4OS, molecular weight 168.18.
It is also registered under: 6-thioxanthine, 6-硫代黄嘌呤.
Category: Organic Chemicals.
Independent reference data for 6-thioxanthine (CAS 2002-59-7), compiled from public chemistry databases.
| CAS Registry Number | 2002-59-7 |
|---|---|
| PubChem CID | 1268107 |
| Molecular formula | C5H4N4OS |
| IUPAC name | 6-sulfanylidene-3,7-dihydropurin-2-one |
| UNII (FDA) | 2HLR5DQG0J |
| Molecular Weight | 168.18 |
|---|---|
| XLogP3 | -0.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 168.01058194 |
| Monoisotopic Mass | 168.01058194 |
| Topological Polar Surface Area | 102 |
| Heavy Atom Count | 11 |
6-Thioxanthine; 2002-59-7; 2HLR5DQG0J; NSC-12160; DTXSID80173842; RefChem:105287; DTXCID7096333; 683-659-2; 6-Mercapto-9H-purin-2-ol; 6-Thioxo-6,9-dihydro-1H-purin-2(3H)-one; 2-Hydroxy-6-mercaptopurine; 6-Mercaptoxanthine; 6-sulfanyl-9H-purin-2-ol; 6-Thioxo-1,3,6,9-tetrahydro-2H-purin-2-one; 6-sulfanylidene-3,7-dihydropurin-2-one; NSC 12160
| Reported hazard statements | H302 (100%), H312 (100%), H332 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
6-thioxanthine · CAS 2002-59-7 · C5H4N4OS. UNII 2HLR5DQG0J.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 6-硫代黄嘌呤