ethyl (E)-2-cyano-3-pyrrolidin-1-ylprop-2-enoate
Basic information
- CAS
63746-09-8- Standard SMILES
CCOC(=O)/C(C#N)=C/N1CCCC1- InChIKey
QLAYEEDSEHPARC-CMDGGOBGSA-N- Molecular formula
- C10H14N2O2
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.10552769
Names & identifiers
- Preferred name
- ethyl (E)-2-cyano-3-pyrrolidin-1-ylprop-2-enoate
- IUPAC
- ethyl (E)-2-cyano-3-pyrrolidin-1-ylprop-2-enoate
Names & synonyms
NSC35947763746-09-8SCHEMBL9449599DTXSID40421553NSC-359477ETHYL (2E)-2-CYANO-3-(PYRROLIDIN-1-YL)PROP-2-ENOATE
Database identifiers
- CAS
63746-09-8- PubChem CID
- 5969342
- DTXSID
DTXSID40421553
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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