2-(4-Amino-3,5-diethylphenyl)ethene-1,1,2-tricarbonitrile
Basic information
- CAS
23957-76-8- Standard SMILES
CCc1cc(C(C#N)=C(C#N)C#N)cc(CC)c1N- InChIKey
HDPUAPGGKQKYSU-UHFFFAOYSA-N- Molecular formula
- C15H14N4
- Average molar mass
- 250.3 g/mol
- Monoisotopic mass
- 250.12184646
Names & identifiers
- Preferred name
- 2-(4-Amino-3,5-diethylphenyl)ethene-1,1,2-tricarbonitrile
- IUPAC
- 2-(4-amino-3,5-diethylphenyl)ethene-1,1,2-tricarbonitrile
- English name
- 2-(4-Amino-3,5-diethylphenyl)-1,1,2-ethenetricarbonitrile
- Molecular formula
- C15H14N4
- Molecular weight
- 250.3
Names & synonyms
2-(4-amino-3,5-diethylphenyl)ethene-1,1,2-tricarbonitrile23957-76-8DTXSID60346951RefChem:251892DTXCID20298023Ethenetricarbonitrile, (4-amino-3,5-diethylphenyl)-HDPUAPGGKQKYSU-UHFFFAOYSA-N2-(4-Amino-3,5-diethylphenyl)-1,1,2-ethenetricarbonitrile(4-Amino-3,5-diethylphenyl)ethene-1,1,2-tricarbonitrile2-(4-Amino-3,5-diethylphenyl)-1,1,2-ethylenetricarbonitrile #1,1,2-Ethenetricarbonitrile, 2-(4-amino-3,5-diethylphenyl)-
Database identifiers
- CAS
23957-76-8- PubChem CID
- 616667
- DTXSID
DTXSID60346951- Nikkaji
- J129.679E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 472
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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