Basic information
- CAS
52298-01-8- Standard SMILES
O=C1OCNc2c1cc([N+](=O)[O-])c1c2C(=O)c2ccccc2C1=O- InChIKey
RASPFILDTJZROS-UHFFFAOYSA-N- Molecular formula
- C16H8N2O6
- Average molar mass
- 324.24 g/mol
- Monoisotopic mass
- 324.03823598
Names & identifiers
- Preferred name
- 2H-Anthra[1,2-d][1,3]oxazine-4,7,12(1H)-trione, 6-nitro-
- IUPAC
- 6-nitro-1,2-dihydronaphtho[2,3-h][3,1]benzoxazine-4,7,12-trione
- English name
- 6-nitro-2H-anthra[1,2-d][1,3]oxazine-4,7,12(1H)-trione
- Molecular formula
- C16H8N2O6
- Molecular weight
- 324.24452
Names & synonyms
EINECS 257-819-36-nitro-2H-anthra[1,2-d][1,3]oxazine-4,7,12(1H)-trione6-Nitro-2H-anthra(1,2-d)(1,3)oxazine-4,7,12(1H)-trione2H-Anthra[1,2-d][1,3]oxazine-4,7,12(1H)-trione, 6-nitro-DTXSID50687322H-Anthra(1,2-d)(1,3)oxazine-4,7,12(1H)-trione, 6-nitro-RefChem:268419DTXCID8041163257-819-3RASPFILDTJZROS-UHFFFAOYSA-N6-Nitro-1H-anthra[1,2-d][1,3]oxazine-4,7,12(2H)-trioneSY354354
Show more names
6-Nitro-1,2,7,12-tetrahydro-4H-anthra[1,2-d][1,3]oxazine-4,7,12-trione
NS00032473
Database identifiers
- CAS
52298-01-8- PubChem CID
- 104142
- DTXSID
DTXSID5068732- EC Number
- 257-819-3
- Nikkaji
- J24.625E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 614
Physicochemical properties
- EPA Substance Registry System
- 2 H-Anthra[1,2-d][1,3]oxazine-4,7,12 · 2H-Anthra[1,2-d][1,3]oxazine-4,7,12(1H)-trione, 6-nitro- (52298-01-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2H-Anthra[1,2-d][1,3]oxazine-4,7,12(1H)-trione, 6-nitro-: ACTIVE
Suppliers1 total
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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