BW A-533U (CAS 85872-58-8) — formula C14H12N4O4, molecular weight 300.27; category organic chemicals.
| CAS Number | 85872-58-8 |
|---|---|
| Molecular Formula | C14H12N4O4 |
| Molecular Weight | 300.27 |
| LogP | 1.7 |
| Category | Organic Chemicals |
BW A-533U is a carbon-based organic compound with CAS registry number 85872-58-8 and molecular formula C14H12N4O4 (molecular weight 300.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85872-58-8
Its molecular formula C14H12N4O4 comprises 14 C, 12 H, 4 N, 4 O atoms.
Also known as: BW A-533U
Category: organic chemicals
The CAS registry number of BW A-533U is 85872-58-8.
Molecular formula C14H12N4O4, molecular weight 300.27.
It is also registered under: BW A-533U.
Category: Organic Chemicals.
Independent reference data for BW A-533U (CAS 85872-58-8), compiled from public chemistry databases.
| CAS 号 | 85872-58-8 |
|---|---|
| PubChem CID | 135109 |
| 分子式 | C14H12N4O4 |
| IUPAC 名称 | 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)benzoic acid |
| Molecular Weight | 300.27 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 300.08585488 |
| Monoisotopic Mass | 300.08585488 |
| Topological Polar Surface Area | 107 |
| Heavy Atom Count | 22 |
BW A533U; 85872-58-8; BW A-533U; Benzoic acid, 4-(2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)-; BW-A533U; DTXSID50235183; RefChem:122420; DTXCID50157674; CHEMBL11048; 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)benzoic acid; SCHEMBL7110639; 8-(4-Carboxyphenyl)theophylline; BDBM50018159; PDSP1_000984; PDSP2_000968; 4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)benzoic acid
BW A-533U · CAS 85872-58-8 · C14H12N4O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: BW A-533U