Benzeneacetic acid, 2-(1H-pyrrol-2-ylmethylene)hydrazide
Basic information
- CAS
67973-81-3- Standard SMILES
O=C(Cc1ccccc1)NN=Cc1ccc[nH]1- InChIKey
NMISWCHMZRGKQP-UHFFFAOYSA-N- Molecular formula
- C13H13N3O
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.10586205
Names & identifiers
- Preferred name
- Benzeneacetic acid, 2-(1H-pyrrol-2-ylmethylene)hydrazide
- IUPAC
- 2-phenyl-N-(1H-pyrrol-2-ylmethylideneamino)acetamide
Names & synonyms
Benzeneacetic acid, 2-(1H-pyrrol-2-ylmethylene)hydrazideDTXSID101198988HMS2788L0367973-81-32-Phenyl-N'-[(1H-pyrrol-2-yl)methylidene]acetohydrazide
Database identifiers
- CAS
67973-81-3- PubChem CID
- 935237
- DTXSID
DTXSID101198988
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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