Basic information
- CAS
6144-43-0- Standard SMILES
Cc1n[nH]c(=O)nc1N/N=C/c1ccccc1[N+](=O)[O-]- InChIKey
LDGWVWGXJPVMHL-WUXMJOGZSA-N- Molecular formula
- C11H10N6O3
- Average molar mass
- 274.24 g/mol
- Monoisotopic mass
- 274.0814382
Names & identifiers
- Preferred name
- 2-Nitrobenzaldehyde (6-methyl-3-oxo-2,3-dihydro-1,2,4-triazin-5-yl)hydrazone
- IUPAC
- 6-methyl-5-[(2E)-2-[(2-nitrophenyl)methylidene]hydrazinyl]-2H-1,2,4-triazin-3-one
Names & synonyms
6144-43-0STK6458882-nitrobenzaldehyde (6-methyl-3-oxo-2,3-dihydro-1,2,4-triazin-5-yl)hydrazoneDTXSID404175126-methyl-5-[(2E)-2-(2-nitrobenzylidene)hydrazinyl]-1,2,4-triazin-3-olAKOS001673819AKOS0055767066-methyl-5-[(2E)-2-[(2-nitrophenyl)methylidene]hydrazinyl]-2H-1,2,4-triazin-3-oneST50189377(E)-6-methyl-5-(2-(2-nitrobenzylidene)hydrazinyl)-1,2,4-triazin-3(2H)-one5-{[(1E)-2-(2-nitrophenyl)-1-azavinyl]amino}-6-methyl-2H-1,2,4-triazin-3-one6-Methyl-5-{(2E)-2-[(2-nitrophenyl)methylidene]hydrazin-1-yl}-1,2,4-triazin-3(2H)-one
Database identifiers
- CAS
6144-43-0- PubChem CID
- 5348552
- DTXSID
DTXSID40417512
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 493
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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