6-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE (CAS 81721-87-1) — formula C8H6N2O4, molecular weight 194.14; category organic chemicals.
| CAS Number | 81721-87-1 |
|---|---|
| Molecular Formula | C8H6N2O4 |
| Molecular Weight | 194.14 |
| LogP | 0.7 |
| Category | Organic Chemicals |
6-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE is a carbon-based organic compound with CAS registry number 81721-87-1 and molecular formula C8H6N2O4 (molecular weight 194.14), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81721-87-1
Its molecular formula C8H6N2O4 comprises 8 C, 6 H, 2 N, 4 O atoms.
Also known as: 6-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE · 6-硝基-2H-1,4-苯并恶唑-3(4H)-酮, 97%
Category: organic chemicals
The CAS registry number of 6-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE is 81721-87-1.
Molecular formula C8H6N2O4, molecular weight 194.14.
It is also registered under: 6-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE, 6-硝基-2H-1,4-苯并恶唑-3(4H)-酮, 97%.
Category: Organic Chemicals.
Independent reference data for 6-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE (CAS 81721-87-1), compiled from public chemistry databases.
| CAS 号 | 81721-87-1 |
|---|---|
| PubChem CID | 2763683 |
| 分子式 | C8H6N2O4 |
| IUPAC 名称 | 6-nitro-4H-1,4-benzoxazin-3-one |
| UNII（FDA） | Z220639074 |
| Molecular Weight | 194.14 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 194.03275668 |
| Monoisotopic Mass | 194.03275668 |
| Topological Polar Surface Area | 84.2 |
| Heavy Atom Count | 14 |
81721-87-1; 6-Nitro-2H-1,4-benzoxazin-3(4H)-one; 6-Nitro-4H-benzo[1,4]oxazin-3-one; DTXSID10377093; 6-Nitro-4H-benzo(1,4)oxazin-3-one; RefChem:544081; DTXCID10328121; 625-359-6; 6-nitro-2H-benzo[b][1,4]oxazin-3(4H)-one; 6-nitro-3,4-dihydro-2H-1,4-benzoxazin-3-one; 6-nitro-4H-1,4-benzoxazin-3-one; MFCD03425744; 2H-1,4-Benzoxazin-3(4H)-one, 6-nitro-; 6-Nitro-2H-[1,4]benzoxazin-3(4H)-one; UPCMLD0ENAT5685869:001; 3-Oxo-6-nitro-3,4-dihydro-2H-1,4-benzoxazine
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (97.6%) |
|---|
6-硝基-2H-1,4-苯并恶唑-3(4H)-酮, 97% · CAS 81721-87-1 · C8H6N2O4. UNII Z220639074.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.