(2R,3R,5R,11R)-3-(hydroxymethyl)-9-imino-2,3,5,9-tetrahydro-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-11-ol (CAS 6698-20-0) — formula C9H11N3O4, molecular weight 225.20; category organic chemicals.
| CAS Number | 6698-20-0 |
|---|---|
| Molecular Formula | C9H11N3O4 |
| Molecular Weight | 225.20 |
| LogP | -1.7 |
| Category | Organic Chemicals |
(2R,3R,5R,11R)-3-(hydroxymethyl)-9-imino-2,3,5,9-tetrahydro-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-11-ol is a carbon-based organic compound with CAS registry number 6698-20-0 and molecular formula C9H11N3O4 (molecular weight 225.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6698-20-0
Its molecular formula C9H11N3O4 comprises 9 C, 11 H, 3 N, 4 O atoms.
Also known as: (2R,3R,5R,11R)-3-(hydroxymethyl)-9-imino-2,3,5,9-tetrahydro-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-11-ol · (2R,3R,5R,11R)-3-(羟甲基)-9-亚氨基-2,3,5,9-四氢-2,5-亚甲基嘧啶基[2,1-b][1,5,3]二恶氮杂-11-醇
Category: organic chemicals
The CAS registry number of (2R,3R,5R,11R)-3-(hydroxymethyl)-9-imino-2,3,5,9-tetrahydro-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-11-ol is 6698-20-0.
Molecular formula C9H11N3O4, molecular weight 225.20.
It is also registered under: (2R,3R,5R,11R)-3-(hydroxymethyl)-9-imino-2,3,5,9-tetrahydro-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-11-ol, (2R,3R,5R,11R)-3-(羟甲基)-9-亚氨基-2,3,5,9-四氢-2,5-亚甲基嘧啶基[2,1-b][1,5,3]二恶氮杂-11-醇.
Category: Organic Chemicals.
Independent reference data for (2R,3R,5R,11R)-3-(hydroxymethyl)-9-imino-2,3,5,9-tetrahydro-2,5-methanopyrimido[2,1-b][1,5,3]dioxazepin-11-ol (CAS 6698-20-0), compiled from public chemistry databases.
| CAS 号 | 6698-20-0 |
|---|---|
| PubChem CID | 10889574 |
| 分子式 | C9H11N3O4 |
| IUPAC 名称 | (1R,9R,10R,12R)-10-(hydroxymethyl)-5-imino-8,11-dioxa-2,6-diazatricyclo[7.2.1.02,7]dodeca-3,6-dien-12-ol |
| Molecular Weight | 225.20 |
|---|---|
| XLogP3 | -1.7 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 225.07495584 |
| Monoisotopic Mass | 225.07495584 |
| Topological Polar Surface Area | 98.4 |
| Heavy Atom Count | 16 |
(2R,3R,5R,11R)-3-(羟甲基)-9-亚氨基-2,3,5,9-四氢-2,5-亚甲基嘧啶基[2,1-b][1,5,3]二恶氮杂-11-醇 · CAS 6698-20-0 · C9H11N3O4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (2R,3R,5R,11R)-3-(羟甲基)-9-亚氨基-2,3,5,9-四氢-2,5-亚甲基嘧啶基[2,1-b][1,5,3]二恶氮杂-11-醇