Basic information
- CAS
77945-07-4- Standard SMILES
CC/C(=C\c1ccccc1)C(=O)OCCN(CC)CC- InChIKey
CFLKJKKPWXMTLX-JQIJEIRASA-N- Molecular formula
- C17H25NO2
- Average molar mass
- 275.4 g/mol
- Monoisotopic mass
- 275.18852904
Names & identifiers
- Preferred name
- Cinnamic acid, alpha-ethyl-, 2-(diethylamino)ethyl ester
- IUPAC
- 2-(diethylamino)ethyl (2E)-2-benzylidenebutanoate
Names & synonyms
Cinnamic acid, alpha-ethyl-, 2-(diethylamino)ethyl ester77945-07-4RefChem:1081806alpha-Ethylcinnamic acid 2-(diethylamino)ethyl esterBRN 31381872-(Diethylamino)ethyl alpha-ethylcinnamatebeta-(Diethylamino)ethyl alpha-ethylcinnamateButanoic acid, 2-(phenylmethylene)-, 2-(diethylamino)ethyl ester
Database identifiers
- CAS
77945-07-4- PubChem CID
- 6435366
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 302
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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