4,4'-Dicyanostilbene
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Basic information
- CAS
5216-37-5- Standard SMILES
N#Cc1ccc(/C=C/c2ccc(C#N)cc2)cc1- InChIKey
RNIZPDIBRXCMRD-OWOJBTEDSA-N- Molecular formula
- C16H10N2
- Average molar mass
- 230.26 g/mol
Names & identifiers
- Preferred name
- 4,4'-Dicyanostilbene
- IUPAC
- 4-[(E)-2-(4-cyanophenyl)ethenyl]benzonitrile
- English name
- 4,4''-Dicyanostilbene
- Molecular formula
- C16H10N2
- Molecular weight
- 230.26
Names & synonyms
4,4'-Dicyanostilbene6292-62-24,4'-(Ethene-1,2-diyl)dibenzonitrile5216-36-4Stilbene-4,4'-dicarbonitrile(E)-4,4'-(ethene-1,2-diyl)dibenzonitrile4,4'-Stilbenedicarbonitrile5216-37-5(E/Z)-4,4'-DicyanostilbeneStilbene-4,4''-dicarbonitrile4-[(E)-2-(4-cyanophenyl)ethenyl]benzonitrileBenzonitrile, 4,4'-(1,2-ethenediyl)bis-
Show more names
4-[2-(4-cyanophenyl)vinyl]benzonitrileBenzonitrile, 4,4'-(1E)-1,2-ethenediylbis-
Benzonitrile,4,4'-(1,2-ethenediyl)bis-4-[(1E)-2-(4-cyanophenyl)ethenyl]benzonitrileMFCD00438701EINECS 228-548-84,4`-Dicyanostilbeneorb1689714SCHEMBL8699093CHEMBL3088207
Database identifiers
- CAS
5216-37-5- ChEMBL
CHEMBL3088207- EC Number
- 228-548-8
- Nikkaji
- J129.464D、J407.929I
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 338
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Physicochemical properties
- Melting point
- 272 · 272-274 °C
- Boiling point
- 445 · 445.0±34.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
Chemistry & industry
Applications
Uses4,4'-Dicyanostilbene (compound 43) is a potent antimalarial agent against the Dd2 strain, with an EC50 of 27 nM. 4,4'-Dicyanostilbene exhibits in vivo efficacy against methicillin-resistant Staphylococcus aureus (MRSA)[1].
Related reactions
0 records
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Compound notes
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