2,3-Dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione(8CI,9CI) (CAS 21056-79-1) — formula C4H4N2O2S2, molecular weight 176.2; category organic chemicals.
| CAS Number | 21056-79-1 |
|---|---|
| Molecular Formula | C4H4N2O2S2 |
| Molecular Weight | 176.2 |
| LogP | -0.6 |
| Category | Organic Chemicals |
2,3-Dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione(8CI,9CI) is a carbon-based organic compound with CAS registry number 21056-79-1 and molecular formula C4H4N2O2S2 (molecular weight 176.2), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 21056-79-1
Its molecular formula C4H4N2O2S2 comprises 4 C, 4 H, 2 N, 2 O, 2 S atoms.
Also known as: 2,3-Dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione(8CI,9CI) · 2,3-二硫基-5,7-二氮杂双环[2.2.2]辛烷-6,8-二酮(8CI,9CI)
Category: organic chemicals
The CAS registry number of 2,3-Dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione(8CI,9CI) is 21056-79-1.
Molecular formula C4H4N2O2S2, molecular weight 176.2.
It is also registered under: 2,3-Dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione(8CI,9CI), 2,3-二硫基-5,7-二氮杂双环[2.2.2]辛烷-6,8-二酮(8CI,9CI).
Category: Organic Chemicals.
Independent reference data for 2,3-Dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione(8CI,9CI) (CAS 21056-79-1), compiled from public chemistry databases.
| CAS 号 | 21056-79-1 |
|---|---|
| PubChem CID | 45099652 |
| 分子式 | C4H4N2O2S2 |
| IUPAC 名称 | 2,3-dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione |
| Molecular Weight | 176.2 |
|---|---|
| XLogP3 | -0.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 175.97141972 |
| Monoisotopic Mass | 175.97141972 |
| Topological Polar Surface Area | 109 |
| Heavy Atom Count | 10 |
21056-79-1; 2,3-DITHIA-5,7-DIAZABICYCLO[2.2.2]OCTANE-6,8-DIONE; orb3173313; SCHEMBL14986942; DTXSID40668027; BDDJKTBQOQJYFJ-UHFFFAOYSA-N
2,3-二硫基-5,7-二氮杂双环[2.2.2]辛烷-6,8-二酮(8CI,9CI) · CAS 21056-79-1 · C4H4N2O2S2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.