Basic information
- CAS
56173-19-4- Standard SMILES
COC(=O)C(C)=NNc1nncc2ccccc12- InChIKey
WVRMLKDOAQEVHB-UHFFFAOYSA-N- Molecular formula
- C12H12N4O2
- Average molar mass
- 244.25 g/mol
- Monoisotopic mass
- 244.09602564
Names & identifiers
- Preferred name
- Methyl 2-[2-(1-phthalazinyl)hydrazinylidene]propanoate
- IUPAC
- methyl 2-(phthalazin-1-ylhydrazinylidene)propanoate
Names & synonyms
Methyl 2-[2-(1-phthalazinyl)hydrazinylidene]propanoateDTXSID90120955956173-19-4Methyl 2-[2-(phthalazin-1-yl)hydrazinylidene]propanoate
Database identifiers
- CAS
56173-19-4- PubChem CID
- 401645
- DTXSID
DTXSID901209559
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…