Morpholine, 4-[2-cyano-3-(4-methoxyphenyl)-1-oxo-2-propenyl]-
Basic information
- CAS
141736-04-1- Standard SMILES
COc1ccc(C=C(C#N)C(=O)N2CCOCC2)cc1- InChIKey
BALDQACWJQTHBW-UHFFFAOYSA-N- Molecular formula
- C15H16N2O3
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.11609238
Names & identifiers
- Preferred name
- Morpholine, 4-[2-cyano-3-(4-methoxyphenyl)-1-oxo-2-propenyl]-
- IUPAC
- 3-(4-methoxyphenyl)-2-(morpholine-4-carbonyl)prop-2-enenitrile
Names & synonyms
3-(4-methoxyphenyl)-2-(morpholine-4-carbonyl)prop-2-enenitrileMorpholine, 4-[2-cyano-3-(4-methoxyphenyl)-1-oxo-2-propenyl]-141736-04-1DTXSID80384491
Database identifiers
- CAS
141736-04-1- PubChem CID
- 2806439
- DTXSID
DTXSID80384491
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 410
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Compound notes
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