Basic information
- CAS
85467-80-7- Standard SMILES
CCOC(=O)[C@]1(c2ccc(F)cc2)C[C@@H]1C[NH+](C)C.[Cl-]- InChIKey
YALUDWVQPQYYRS-YLCXCWDSSA-N- Molecular formula
- C15H21ClFNO2
- Average molar mass
- 301.78 g/mol
- Monoisotopic mass
- 301.1244848
Names & identifiers
- Preferred name
- Cyclopropanecarboxylic acid, 2-((dimethylamino)methyl)-1-(p-fluorophenyl)-, ethyl ester, (Z)-, monohydrochloride
- IUPAC
- [(1S,2R)-2-ethoxycarbonyl-2-(4-fluorophenyl)cyclopropyl]methyl-dimethylazanium chloride
Names & synonyms
85467-80-7Cyclopropanecarboxylic acid, 2-((dimethylamino)methyl)-1-(p-fluorophenyl)-, ethyl ester, (Z)-, monohydrochloride(Z)-2-((Dimethylamino)methyl)-1-(p-fluorophenyl)cyclopropanecarboxylic acid ethyl ester HClRefChem:336255
Database identifiers
- CAS
85467-80-7- PubChem CID
- 55359
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…