Ketone, p-ethoxyphenyl 2-pyridyl
Basic information
- CAS
32941-23-4- Standard SMILES
CCOc1ccc(C(=O)c2ccccn2)cc1- InChIKey
PNYIMMUCLUTXQE-UHFFFAOYSA-N- Molecular formula
- C14H13NO2
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.09462866
Names & identifiers
- Preferred name
- Ketone, p-ethoxyphenyl 2-pyridyl
- IUPAC
- (4-ethoxyphenyl)-pyridin-2-ylmethanone
- English name
- 2-(4-Ethoxybenzoyl)pyridine
- Molecular formula
- C14H13NO2
- Molecular weight
- 227.26
Names & synonyms
32941-23-4p-Ethoxyphenyl 2-pyridylketoneKetone, p-ethoxyphenyl 2-pyridylBRN 1530667DTXSID80186593RefChem:350488DTXCID201090842-(4-Ethoxybenzoyl)pyridine(4-ethoxyphenyl)(pyridin-2-yl)methanone(4-ethoxyphenyl)-pyridin-2-ylmethanoneMFCD01716510PNYIMMUCLUTXQE-UHFFFAOYSA-N
Show more names
(4-Ethoxyphenyl)-2-pyridinylmethanoneMethanone, (4-ethoxyphenyl)-2-pyridinyl-
AKOS012086020(4-ethoxyphenyl)-(2-pyridyl)methanoneCS-0362976F202557
Database identifiers
- CAS
32941-23-4- PubChem CID
- 208758
- DTXSID
DTXSID80186593
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- Boiling point
- 368.97 °C · 368.97°C (rough estimate)
- Density
- 1.1223 · 1.1223 (rough estimate)
- refractive index
- 1.578 · 1.5780 (estimate)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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