2-[(2,4-Dihydroxyphenyl)methylene]propanedinitrile
Basic information
- CAS
92279-39-5- Standard SMILES
N#CC(C#N)=Cc1ccc(O)cc1O- InChIKey
HHQXKJPSAWMRGJ-UHFFFAOYSA-N- Molecular formula
- C10H6N2O2
- Average molar mass
- 186.17 g/mol
- Monoisotopic mass
- 186.04292744
Names & identifiers
- Preferred name
- 2-[(2,4-Dihydroxyphenyl)methylene]propanedinitrile
- IUPAC
- 2-[(2,4-dihydroxyphenyl)methylidene]propanedinitrile
Names & synonyms
92279-39-52-((2,4-Dihydroxyphenyl)methylene)propanedinitrile2-[(2,4-Dihydroxyphenyl)methylene]propanedinitrileRefChem:249168Propanedinitrile, [(2,4-dihydroxyphenyl)methylene]-Phenethylene, 2,2-dicyano-2',4'-dihydroxy-SCHEMBL29492373DTXSID70344125HHQXKJPSAWMRGJ-UHFFFAOYSA-N2-(2,4-Dihydroxybenzylidene)malononitrile #Phenylethylene, 2,2-dicyano-2',4'-dihydroxy-[(2,4-Dihydroxyphenyl)methylidene]propanedinitrile
Database identifiers
- CAS
92279-39-5- PubChem CID
- 594573
- DTXSID
DTXSID70344125
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 88 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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