5,8-dibromoisoquinoline (CAS 81045-39-8) — formula C9H5Br2N, molecular weight 286.95; category organic chemicals.
| CAS Number | 81045-39-8 |
|---|---|
| Molecular Formula | C9H5Br2N |
| Molecular Weight | 286.95 |
| LogP | 3.5 |
| Category | Organic Chemicals |
5,8-dibromoisoquinoline is a carbon-based organic compound with CAS registry number 81045-39-8 and molecular formula C9H5Br2N (molecular weight 286.95), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81045-39-8
Its molecular formula C9H5Br2N comprises 9 C, 5 H, 2 Br, 1 N atoms.
Also known as: 5,8-dibromoisoquinoline · 5,8-二溴异喹啉
Category: organic chemicals
The CAS registry number of 5,8-dibromoisoquinoline is 81045-39-8.
Molecular formula C9H5Br2N, molecular weight 286.95.
It is also registered under: 5,8-dibromoisoquinoline, 5,8-二溴异喹啉.
Category: Organic Chemicals.
Independent reference data for 5,8-dibromoisoquinoline (CAS 81045-39-8), compiled from public chemistry databases.
| CAS Registry Number | 81045-39-8 |
|---|---|
| PubChem CID | 271281 |
| Molecular formula | C9H5Br2N |
| IUPAC name | 5,8-dibromoisoquinoline |
| UNII (FDA) | ST45037763 |
| Molecular Weight | 286.95 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 286.87682 |
| Monoisotopic Mass | 284.87887 |
| Topological Polar Surface Area | 12.9 |
| Heavy Atom Count | 12 |
5,8-dibromoisoquinoline; DTXSID40297215; RefChem:528328; DTXCID30248352; 687-940-0; 81045-39-8; MFCD03109888; 5,8-Dibromo-isoquinoline; Isoquinoline, 5,8-dibromo-; MLS002706591; NSC114747; 5,8-(Dibromo)isoquinoline; SCHEMBL244397; CHEMBL2130516; 5,8-Dibromo isoquinoline; AMY1655
| Reported hazard statements | H302 (33.3%), H315 (100%), H319 (100%), H335 (66.7%) |
|---|
H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
5,8-dibromoisoquinoline · CAS 81045-39-8 · C9H5Br2N. UNII ST45037763.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5,8-二溴异喹啉