4-(2-Furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
Basic information
- CAS
64089-27-6- Standard SMILES
CC1=C(C#N)C(c2ccco2)C(C#N)=C(C)N1- InChIKey
RDWGHKWLVZMGQQ-UHFFFAOYSA-N- Molecular formula
- C13H11N3O
- Average molar mass
- 225.25 g/mol
- Monoisotopic mass
- 225.09021198
Names & identifiers
- Preferred name
- 4-(2-Furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
- IUPAC
- 4-(furan-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
Names & synonyms
4-(2-furyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrileOprea1_271046AE-641/30076038SCHEMBL7820645CCG-46151AKOS022655496ST50449109SR-01000635865-14-FURAN-2-YL-2,6-DIMETHYL-1,4-DIHYDRO-PYRIDINE-3,5-DICARBONITRILE
Database identifiers
- CAS
64089-27-6- PubChem CID
- 737073
- EC Number
- 158-154-0
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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