ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
Basic information
- CAS
40448-81-5- Standard SMILES
C=COC(=O)N1c2ccc(C)cc2C=CC1C#N- InChIKey
DJFQWKGKANUZJQ-UHFFFAOYSA-N- Molecular formula
- C14H12N2O2
- Average molar mass
- 240.26 g/mol
- Monoisotopic mass
- 240.08987763
Names & identifiers
- Preferred name
- ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
- IUPAC
- ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
Names & synonyms
40448-81-5ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylateNSC166145DTXSID90304524NSC-166145ethenyl 2-cyano-6-methylquinoline-1(2H)-carboxylate
Database identifiers
- CAS
40448-81-5- PubChem CID
- 296228
- DTXSID
DTXSID90304524
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 421
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Compound notes
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