Pyridinium, 1-(2-ethoxy-2-oxoethyl)-2-methyl-, bromide (1:1)
Basic information
- CAS
55814-02-3- Standard SMILES
CCOC(=O)C[n+]1ccccc1C.[Br-]- InChIKey
ZBUYMIGDJRGWLE-UHFFFAOYSA-M- Molecular formula
- C10H14BrNO2
- Average molar mass
- 260.13 g/mol
- Monoisotopic mass
- 259.02079
Names & identifiers
- Preferred name
- Pyridinium, 1-(2-ethoxy-2-oxoethyl)-2-methyl-, bromide (1:1)
- IUPAC
- ethyl 2-(2-methylpyridin-1-ium-1-yl)acetate bromide
Names & synonyms
55814-02-3RefChem:1097347Pyridinium, 1-(2-ethoxy-2-oxoethyl)-2-methyl-, bromide (1:1)Carbethoxymethyl-alpha-picolinium bromide2-Picolinium, 1-(ethoxycarbonylmethyl)-, bromide2-Picolinium, 1-(carboxymethyl)-, bromide, ethyl esterDTXSID50971216NSC99352NSC 99352NSC-993521-ethoxycarbonylmethyl-2-methylpyridinium bromideethyl 2-(2-methylpyridin-1-ium-1-yl)acetate;bromide
Show more names
1-(2-ETHOXY-2-OXOETHYL)-2-METHYLPYRIDIN-1-IUM BROMIDE
Database identifiers
- CAS
55814-02-3- PubChem CID
- 108772
- DTXSID
DTXSID50971216
Properties
Computed structural properties
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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