6-thiotheophylline (CAS 2398-70-1) — formula C7H8N4OS, molecular weight 196.23; category organic chemicals.
6-thiotheophylline (CAS 2398-70-1) is a chemical raw material in the organic chemicals category. Its molecular formula C7H8N4OS comprises 7 C, 8 H, 4 N, 1 O, 1 S atoms. Its molecular weight is about 196.23. Reported physicochemical data: LogP about 0.6. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 2398-70-1 |
|---|---|
| Molecular Formula | C7H8N4OS |
| Molecular Weight | 196.23 |
| LogP | 0.6 |
| Category | Organic Chemicals |
6-thiotheophylline is a carbon-based organic compound with CAS registry number 2398-70-1 and molecular formula C7H8N4OS (molecular weight 196.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2398-70-1
Its molecular formula C7H8N4OS comprises 7 C, 8 H, 4 N, 1 O, 1 S atoms.
Also known as: 6-thiotheophylline · 6-硫代茶碱
Category: organic chemicals
The CAS registry number of 6-thiotheophylline is 2398-70-1.
Molecular formula C7H8N4OS, molecular weight 196.23.
It is also registered under: 6-thiotheophylline, 6-硫代茶碱.
Category: Organic Chemicals.
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Independent reference data for 6-thiotheophylline (CAS 2398-70-1), compiled from public chemistry databases.
| CAS Number | 2398-70-1 |
|---|---|
| PubChem CID | 3036595 |
| Molecular Formula | C7H8N4OS |
| IUPAC Name | 1,3-dimethyl-6-sulfanylidene-7H-purin-2-one |
| Molecular Weight | 196.23 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 0 |
| Exact Mass | 196.04188206 |
| Monoisotopic Mass | 196.04188206 |
| Topological Polar Surface Area | 84.3 |
| Heavy Atom Count | 13 |
6-Thiotheophylline; 2398-70-1; DTXSID10178704; RefChem:105286; DTXCID30101195; 1,3-dimethyl-6-sulfanylidene-7H-purin-2-one; SCHEMBL9258216; FDDCBLYAEALGPZ-UHFFFAOYSA-N; purin-2(1H)-one, 3,6-dihydro-1,3-dimethyl-6-thioxo-; 1,3-Dimethyl-6-thioxo-1,3,6,7-tetrahydro-2H-purin-2-one #; 2H-Purin-2-one, 1,3,6,7-tetrahydro-1,3-dimethyl-6-thioxo-; 1,3-Dimethyl-6-sulfanylidene-1,3,6,7-tetrahydro-2H-purin-2-one
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 6-硫代茶碱