4,4'-Dicyanostilbene
Basic information
- CAS
6292-62-2- 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
- Monoisotopic mass
- 230.08439833
Names & identifiers
- Preferred name
- 4,4'-Dicyanostilbene
- IUPAC
- 4-[(E)-2-(4-cyanophenyl)ethenyl]benzonitrile
- English name
- stilbene-4,4'-dicarbonitrile
- Molecular formula
- C16H10N2
- Molecular weight
- 230.26
Names & synonyms
4,4'-Dicyanostilbene6292-62-24,4'-(Ethene-1,2-diyl)dibenzonitrileStilbene-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-MFCD00438701
Show more names
4,4-DICYANOSTILBENE(WXG00901)4,4'-(1,2-Ethenediyl)bisbenzonitrile
Benzonitrile,4,4'-(1,2-ethenediyl)bis-ZINC2257054-[(1E)-2-(4-cyanophenyl)ethenyl]benzonitrileEINECS 228-548-84,4`-Dicyanostilbene44DICYANOSTILBENE(E)44DICYANOSTILBENE44STILBENEDICARBONITRILE
Database identifiers
- CAS
6292-62-2- PubChem CID
- 759338
- ChEMBL
CHEMBL3088207- EC Number
- 228-548-8
- Nikkaji
- J129.464D、J407.929I
Properties
Computed structural properties
- 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
- 278 °C · 278 °C
- Boiling point
- 445 · 445.0±34.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- form
- Solid
- color
- White to off-white
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses(E/Z)-4,4'-Dicyanostilbene is the isomer of 4,4'-Dicyanostilbene (HY-W112166A), and can be used as an experimental control. 4,4'-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
No reaction records under the current filter.
Compound notes
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