Basic information
- CAS
18343-00-5- Standard SMILES
CCOC(=O)C(C)Oc1cccnc1- InChIKey
ISQCDEKGVOBAAW-UHFFFAOYSA-N- Molecular formula
- C10H13NO3
- Average molar mass
- 195.21 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(3-pyridinyloxy)propanoate
- IUPAC
- ethyl 2-pyridin-3-yloxypropanoate
- English name
- Propanoic acid, 2-(3-pyridinyloxy)-, ethyl ester (9CI)
- Molecular formula
- C10H13NO3
- Molecular weight
- 195.22
Names & synonyms
ethyl 2-(3-pyridinyloxy)propanoate18343-00-5ethyl 2-pyridin-3-yloxypropanoatePropanoic acid, 2-(3-pyridinyloxy)-, ethyl ester (9CI)SCHEMBL1974134ISQCDEKGVOBAAW-UHFFFAOYSA-NAKOS0113521432-pyridin-3-yloxy-propionic acid ethyl ester2-(pyridin-3-yloxy)-propionic acid ethyl esterPropanoic acid, 2-(3-pyridinyloxy)-, ethyl ester
Database identifiers
- CAS
18343-00-5
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Boiling point
- 280.1 · 280.1±15.0 °C(Predicted)
- Density
- 1.105 · 1.105±0.06 g/cm3(Predicted)
- pka
- 4.39 · 4.39±0.10(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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