Account 1-(7,8-Dinitro-4,5-dihydro-1H-1,5-methanobenzo[d]azepin-3(2H)-yl)-2,2,2-trifluoroethanone
- Catalog No. :
- ACMIND958
- CAS No. :
- 230615-59-5
- Molecular Formula :
- C13H10F3N3O5
- Molecular Weight :
- 345.23
IUPAC Name:1-(7,8-dinitro-1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)-2,2,2-trifluoroethan-1-one
![1-(7,8-Dinitro-4,5-dihydro-1H-1,5-methanobenzo[d]azepin-3(2H)-yl)-2,2,2-trifluoroethanone structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 1-(7,8-Dinitro-4,5-dihydro-1H-1,5-methanobenzo[d]azepin-3(2H)-yl)-2,2,2-trifluoroethanone |
|---|---|
| IUPAC Name | 1-(7,8-dinitro-1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)-2,2,2-trifluoroethan-1-one |
| MDL No. | MFCD10566032 |
| Molecular Formula | C13H10F3N3O5 |
| Molecular Weight | 345.23 |
| SMILES | FC(F)(F)C(N1CC(C2)C3=CC([N+]([O-])=O)=C([N+]([O-])=O)C=C3C2C1)=O |
| InChI Key | BDTXJBWOCIFUMR-UHFFFAOYSA-N |
| Synonym | 1-(4,5-Dinitro-10-aza-tricyclo[6.3.1.02.7]dodeca-2(7),3.5-trien-10-yl)-2.2.2-trifluoro-ethanone | MFCD22208548 | 1-(4,5-Dinitro-10-aza-tricyclo[6.3.1.02,7]dodeca-2(7),3,5-trien-10-yl)-2,2,2-trifluoro-ethanone | 1-(4,5-Dinitro-10-aza-tricyclo[6.3.1.02.7]do |
| CAS No. | 230615-59-5 |
| PubChem CID | 21864744 |
Safety Data
- Pictogram
- Signal Word
- Gefahr
- Hazard Statement(s)
- H228-H315-H319
- Precautionary Statement(s)
- P210-P240-P241-P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P370+P378
Synthetic Route by SureRoute
2. ACMIND958 Molecular Building Block Synthetic Route
1-(7-amino-8-nitro-1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)-2,2,2-trifluoroethan-1-one
1-(7,8-Dinitro-1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)ethan-1-one
2,2,2-Trifluoro-1-(7-nitro-1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)ethan-1-one