Basic information
- CAS
5746-65-6- Standard SMILES
CCCn1nnc(NC(=O)c2ccccc2[N+](=O)[O-])n1- InChIKey
DJJMBPKLZDFFIV-UHFFFAOYSA-N- Molecular formula
- C11H12N6O3
- Average molar mass
- 276.25 g/mol
- Monoisotopic mass
- 276.09708827
Names & identifiers
- Preferred name
- 2-nitro-N-(2-propyltetrazol-5-yl)benzamide
- IUPAC
- 2-nitro-N-(2-propyltetrazol-5-yl)benzamide
Names & synonyms
2-nitro-N-(2-propyl-2H-tetrazol-5-yl)benzamide5746-65-62-nitro-N-(2-propyltetrazol-5-yl)benzamideDTXSID90972944STK864139AKOS001049291SR-01000265721SR-01000265721-1Z569067762-Nitro-N-(2-propyl-1,2-dihydro-5H-tetrazol-5-ylidene)benzamide
Database identifiers
- CAS
5746-65-6- PubChem CID
- 893503
- DTXSID
DTXSID90972944
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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