Basic information
- CAS
63906-44-5- Standard SMILES
C[NH+](C)CCOC(=O)COc1ccccc1.[Cl-]- InChIKey
PFQDPIRIPKGLJL-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO3
- Average molar mass
- 259.73 g/mol
- Monoisotopic mass
- 259.0975211
Names & identifiers
- Preferred name
- Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride
- IUPAC
- dimethyl-[2-(2-phenoxyacetyl)oxyethyl]azanium chloride
Names & synonyms
ACETIC ACID, PHENOXY-, 2-DIMETHYLAMINOETHYL ESTER, HYDROCHLORIDE63906-44-5RefChem:1075832Phenoxyacetic acid 2-(dimethylamino)ethyl ester hydrochloride
Database identifiers
- CAS
63906-44-5- PubChem CID
- 45153
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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