1,7-dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene (CAS 85579-17-5) — formula C5H4N2O2S2, molecular weight 188.2; category organic chemicals.
| CAS Number | 85579-17-5 |
|---|---|
| Molecular Formula | C5H4N2O2S2 |
| Molecular Weight | 188.2 |
| LogP | 1.3 |
| Category | Organic Chemicals |
1,7-dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene is a carbon-based organic compound with CAS registry number 85579-17-5 and molecular formula C5H4N2O2S2 (molecular weight 188.2), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85579-17-5
Its molecular formula C5H4N2O2S2 comprises 5 C, 4 H, 2 N, 2 O, 2 S atoms.
Also known as: 1,7-dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene · 1,7-二氧杂-2,6-二氮杂-4,7a-二硫基-3H,5H-苯并(cd)并环戊二烯
Category: organic chemicals
The CAS registry number of 1,7-dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene is 85579-17-5.
Molecular formula C5H4N2O2S2, molecular weight 188.2.
It is also registered under: 1,7-dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene, 1,7-二氧杂-2,6-二氮杂-4,7a-二硫基-3H,5H-苯并(cd)并环戊二烯.
Category: Organic Chemicals.
Independent reference data for 1,7-dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene (CAS 85579-17-5), compiled from public chemistry databases.
| CAS 号 | 85579-17-5 |
|---|---|
| PubChem CID | 3036269 |
| 分子式 | C5H4N2O2S2 |
| IUPAC 名称 | 3,5-dioxa-4λ4,9-dithia-2,6-diazatricyclo[5.3.1.04,11]undeca-1,4(11),6-triene |
| Molecular Weight | 188.2 |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 0 |
| Exact Mass | 187.97141972 |
| Monoisotopic Mass | 187.97141972 |
| Topological Polar Surface Area | 87.7 |
| Heavy Atom Count | 11 |
Hep-II; 1,7-Dioxa-2,6-diaza-4,7a-dithia-3H,5H-benzo(cd)pentalene; 85579-17-5; DTXSID60234783; RefChem:73692; DTXCID90157274; SCHEMBL30556436; 3,5-dioxa-4lambda4,9-dithia-2,6-diazatricyclo[5.3.1.04,11]undeca-1,4(11),6-triene; 5H,7H-2,3-Dioxa-2alambda4,6-dithia-1,4-diazacyclopent(cd)indene; 5H,7H-2,3-Dioxa-2alambda~4~,6-dithia-1,4-diazacyclopenta[cd]indene
1,7-二氧杂-2,6-二氮杂-4,7a-二硫基-3H,5H-苯并(cd)并环戊二烯 · CAS 85579-17-5 · C5H4N2O2S2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.