Benzofurazan, 4-nitro-7-(4-propyl-1-piperazinyl)-, 1-oxide
Basic information
- CAS
61785-52-2- Standard SMILES
CCCN1CCN(c2ccc([N+](=O)[O-])c3no[n+]([O-])c23)CC1- InChIKey
YUXYRWBLHMZNFB-UHFFFAOYSA-N- Molecular formula
- C13H17N5O4
- Average molar mass
- 307.31 g/mol
- Monoisotopic mass
- 307.12805404
Names & identifiers
- Preferred name
- Benzofurazan, 4-nitro-7-(4-propyl-1-piperazinyl)-, 1-oxide
- IUPAC
- 7-nitro-3-oxido-4-(4-propylpiperazin-1-yl)-2,1,3-benzoxadiazol-3-ium
- English name
- 4-Nitro-7-(4-propyl-1-piperazinyl)benzofurazane 1-oxide
- Molecular formula
- C13H17N5O4
- Molecular weight
- 307.31
Names & synonyms
61785-52-2BENZOFURAZAN, 4-NITRO-7-(4-PROPYL-1-PIPERAZINYL)-, 1-OXIDE4-(4-Propylpiperazinyl)-7-nitrobenzofuroxanNSC228105NSC 2281054-Nitro-7-(4-propyl-1-piperazinyl)benzofurazan 1-oxide7-nitro-3-oxido-4-(4-propylpiperazin-1-yl)-2,1,3-benzoxadiazol-3-ium4-Nitro-7-(4-propyl-1-piperazinyl)benzofurazane 1-oxideDTXSID70210775NSC-228105DB-316692WLN: T56 BNONJ BO FNW I- AT6N DNTJ D3
Show more names
B-27662,1,3-Benzoxadiazole, 4-nitro-7-(4-propyl-1-piperazinyl)-, 1-oxide
4-Nitro-1-oxo-7-(4-propylpiperazin-1-yl)-2,1lambda~5~,3-benzoxadiazole
Database identifiers
- CAS
61785-52-2- PubChem CID
- 43788
- DTXSID
DTXSID70210775- Nikkaji
- J71.586G
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 398
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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