Basic information
- CAS
36874-67-6- Standard SMILES
CCOC(=O)C(C#N)=NNc1cccc(Cl)c1- InChIKey
FSIFRTHCIGOKNH-UHFFFAOYSA-N- Molecular formula
- C11H10ClN3O2
- Average molar mass
- 251.67 g/mol
- Monoisotopic mass
- 251.0461543
Names & identifiers
- Preferred name
- Ethyl [2-(3-chlorophenyl)hydrazinylidene](cyano)acetate
- IUPAC
- ethyl 2-[(3-chlorophenyl)hydrazinylidene]-2-cyanoacetate
Names & synonyms
SCHEMBL31597668SCHEMBL38652827DTXSID00876282Ethyl [2-(3-chlorophenyl)hydrazinylidene](cyano)acetateEthyl 2-[2-(3-chlorophenyl)hydrazinylidene]-2-cyanoacetate
Database identifiers
- CAS
36874-67-6- PubChem CID
- 37564
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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