2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene (CAS 1502-46-1) — formula C6H3N7O3, molecular weight 221.13; category organic chemicals.
2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene is a carbon-based organic compound with CAS registry number 1502-46-1 and molecular formula C6H3N7O3 (molecular weight 221.13), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1502-46-1
Its molecular formula C6H3N7O3 comprises 6 C, 3 H, 7 N, 3 O atoms.
Also known as: 2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene · 1,3,3a1,4,6,7,9-七氮杂萉-2,5,8(1H,3H,6H)-三酮
Category: organic chemicals
The CAS registry number of 2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene is 1502-46-1.
Molecular formula C6H3N7O3, molecular weight 221.13.
It is also registered under: 2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene, 1,3,3a1,4,6,7,9-七氮杂萉-2,5,8(1H,3H,6H)-三酮.
Category: Organic Chemicals.
Public-database records for 2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene (CAS 1502-46-1), reproduced here for independent cross-checking.
| CAS 号 | 1502-46-1 |
|---|---|
| PubChem CID | 291317 |
| 分子式 | C6H3N7O3 |
| IUPAC 名称 | 2,4,6,8,10,12,13-heptazatricyclo[7.3.1.05,13]trideca-1,4,8-triene-3,7,11-trione |
| UNII(FDA) | FC54F41J58 |
1502-46-1; 1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione; Cyameluric acid; 1,3,3A1,4,6,7,9-heptaazaphenalene-2,5,8(1H,3H,6H)-trione; 1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8-triol; 1,3,3a1,4,6,7,9-heptaazaphenalene-2,5,8-triol; NSC156433; 2,5,8-Trihydroxy-1,3,4,6,7,9,9b-heptaaza-9bH-phenalene; FC54F41J58; 2,4,6,8,10,12,13-heptazatricyclo[7.3.1.05,13]trideca-1,4,8-triene-3,7,11-trione; NSC-156433; NSC 156433; BAS 00721841; UNII-FC54F41J58; C6H3N7O3; SCHEMBL12631716
| 分子量 | 221.13 |
|---|---|
| XLogP3 | -1.5 |
| 氢键供体数 | 3 |
| 氢键受体数 | 3 |
| 可旋转键数 | 0 |
| 精确质量 | 221.02973698 |
| 单同位素质量 | 221.02973698 |
| 拓扑极性表面积 | 128 |
| 重原子数 | 16 |
| 形式电荷 | 0 |
1,3,3a1,4,6,7,9-七氮杂萉-2,5,8(1H,3H,6H)-三酮 · CAS 1502-46-1 · C6H3N7O3. UNII FC54F41J58.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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