Theophylline Impurity 1 (CAS 5614-53-9) — formula C9H10N4O3, molecular weight 222.20; category pharmaceutical intermediates and APIs.
Theophylline Impurity 1 (CAS 5614-53-9) is a chemical raw material in the pharmaceutical intermediates and APIs category. Its molecular formula C9H10N4O3 comprises 9 C, 10 H, 4 N, 3 O atoms. Its molecular weight is about 222.20. Reported physicochemical data: LogP about -0.8. 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 | 5614-53-9 |
|---|---|
| Molecular Formula | C9H10N4O3 |
| Molecular Weight | 222.20 |
| LogP | -0.8 |
| Category | Pharmaceutical Intermediates & APIs |
Theophylline Impurity 1 is a pharmaceutical intermediate or API compound with CAS registry number 5614-53-9 and molecular formula C9H10N4O3 (molecular weight 222.20), belonging to the pharmaceutical intermediates and APIs segment of chemical raw materials.
CAS number: 5614-53-9
Its molecular formula C9H10N4O3 comprises 9 C, 10 H, 4 N, 3 O atoms.
Also known as: Theophylline Impurity 1 · 多索茶碱杂质2
Category: pharmaceutical intermediates and APIs
The CAS registry number of Theophylline Impurity 1 is 5614-53-9.
Molecular formula C9H10N4O3, molecular weight 222.20.
It is also registered under: Theophylline Impurity 1, 多索茶碱杂质2.
Category: Pharmaceutical Intermediates & APIs.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Theophylline Impurity 1 (CAS 5614-53-9), compiled from public chemistry databases.
| CAS Number | 5614-53-9 |
|---|---|
| PubChem CID | 14482471 |
| Molecular Formula | C9H10N4O3 |
| IUPAC Name | 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetaldehyde |
| UNII (FDA) | KP5Z8JL7A6 |
| Molecular Weight | 222.20 |
|---|---|
| XLogP3 | -0.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 222.07529019 |
| Monoisotopic Mass | 222.07529019 |
| Topological Polar Surface Area | 75.5 |
| Heavy Atom Count | 16 |
5614-53-9; theophylline-7-acetaldehyde; KP5Z8JL7A6; RefChem:1099804; Doxofylline Impurity 2; 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetaldehyde; Theophylline acetaldehyde; 7-Theophyllineacetaldehyde; Doxophylline metabolite M1; 7-(Formylmethyl)theophylline; 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetaldehyde; (1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetaldehyde; UNII-KP5Z8JL7A6; 1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetaldehyde; 7H-Purine-7-acetaldehyde, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-; 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl) acetaldehyde
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 多索茶碱杂质2