2-(5-Ethyl-2-pyridyl)ethyl acrylate
Basic information
- CAS
122-93-0- Standard SMILES
C=CC(=O)OCCc1ccc(CC)cn1- InChIKey
WNNZOJYVMCYPRO-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
- Monoisotopic mass
- 205.11027872
Names & identifiers
- Preferred name
- 2-(5-Ethyl-2-pyridyl)ethyl acrylate
- IUPAC
- 2-(5-ethyl-2-pyridinyl)ethyl prop-2-enoate
- English name
- 2-(5-Ethyl-2-pyridinyl)ethyl=acrylate
- Molecular formula
- C12H15NO2
- Molecular weight
- 205.25
Names & synonyms
2-(5-Ethyl-2-pyridyl)ethyl acrylate2-(5-Ethyl-2-pyridyl)ethyl propenoate502X6TP4GCACRYLIC ACID, 2-(5'-ETHYLPYRID-2'-YL)ETHYL ESTERUNII-502X6TP4GCDTXSID50153459ACRYLIC ACID, 2-(5-ETHYL-2-PYRIDYL)ETHYL ESTER2-PROPENOIC ACID, 2-(5-ETHYL-2-PYRIDINYL)ETHYL ESTERRefChem:197606DTXCID40759502-(5-ethylpyridin-2-yl)ethyl prop-2-enoate122-93-0
Show more names
Acrylic acid 2-(5-ethyl-2-pyridinyl)ethyl ester
2-(5-Ethyl-2-pyridinyl)ethyl=acrylateSCHEMBL4631640DB-250662Q27260739
Database identifiers
- CAS
122-93-0- PubChem CID
- 31232
- DTXSID
DTXSID50153459- UNII
- 502X6TP4GC
- Nikkaji
- J73.331H
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- Boiling point
- 343.93 °C · 343.93°C (rough estimate)
- Density
- 1.0958 · 1.0958 (rough estimate)
- refractive index
- 1.516 · 1.5160 (estimate)
- pka
- 5.23 · 5.23±0.22(Predicted)
- FDA UNII
- 502 X6TP4GC · 502X6TP4GC
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…