N'-(2,4-dimethylbenzoyl)-2-methyl-3-nitrobenzohydrazide
Basic information
- CAS
877977-16-7- Standard SMILES
Cc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2C)c(C)c1- InChIKey
TVYGXJSUYLCRAT-UHFFFAOYSA-N- Molecular formula
- C17H17N3O4
- Average molar mass
- 327.33 g/mol
- Monoisotopic mass
- 327.12190603
Names & identifiers
- Preferred name
- N'-(2,4-dimethylbenzoyl)-2-methyl-3-nitrobenzohydrazide
- IUPAC
- N'-(2,4-dimethylbenzoyl)-2-methyl-3-nitrobenzohydrazide
Names & synonyms
N'-(2,4-dimethylbenzoyl)-2-methyl-3-nitrobenzohydrazideDTXSID1011829912-Methyl-3-nitrobenzoic acid 2-(2,4-dimethylbenzoyl)hydrazideAKOS001206339877977-16-7Z27110831
Database identifiers
- CAS
877977-16-7- PubChem CID
- 7808933
- DTXSID
DTXSID101182991
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 491
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