5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine (CAS 80987-71-9) — formula C9H7N3O3, molecular weight 205.17; category organic chemicals.
| CAS Number | 80987-71-9 |
|---|---|
| Molecular Formula | C9H7N3O3 |
| Molecular Weight | 205.17 |
| LogP | 0.9 |
| Category | Organic Chemicals |
5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine is a carbon-based organic compound with CAS registry number 80987-71-9 and molecular formula C9H7N3O3 (molecular weight 205.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 80987-71-9
Its molecular formula C9H7N3O3 comprises 9 C, 7 H, 3 N, 3 O atoms.
Also known as: 5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine · 5-(1,3-二氧杂茚烷-5-基)-1,3,4-噁二唑-2-胺
Category: organic chemicals
The CAS registry number of 5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine is 80987-71-9.
Molecular formula C9H7N3O3, molecular weight 205.17.
It is also registered under: 5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine, 5-(1,3-二氧杂茚烷-5-基)-1,3,4-噁二唑-2-胺.
Category: Organic Chemicals.
Independent reference data for 5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine (CAS 80987-71-9), compiled from public chemistry databases.
| CAS 号 | 80987-71-9 |
|---|---|
| PubChem CID | 3067251 |
| 分子式 | C9H7N3O3 |
| IUPAC 名称 | 5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine |
| UNII（FDA） | ST50977984 |
| Molecular Weight | 205.17 |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 205.04874109 |
| Monoisotopic Mass | 205.04874109 |
| Topological Polar Surface Area | 83.4 |
| Heavy Atom Count | 15 |
80987-71-9; 5-(1,3-Benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine; BRN 0526448; 1,3,4-Oxadiazol-2-amine, 5-(1,3-benzodioxol-5-yl)-; DTXSID50230830; RefChem:216865; DTXCID80153321; 5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-amine; MFCD00450153; 1,3,4-Oxadiazol-2-amine,5-(1,3-benzodioxol-5-yl)-; 5-(benzo[d][1,3]dioxol-5-yl)-1,3,4-oxadiazol-2-amine; F2182-0022; 5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-ylamine; SCHEMBL24653524; SCHEMBL30622710; SMSSF-0017726
| 已通报的危害声明 | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
5-(1,3-二氧杂茚烷-5-基)-1,3,4-噁二唑-2-胺 · CAS 80987-71-9 · C9H7N3O3. UNII ST50977984.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.