Basic information
- CAS
85467-32-9- Standard SMILES
CCOC(=O)[C@]1(c2ccccc2)C[C@@H]1C[NH2+]Cc1ccccc1.[Cl-]- InChIKey
JLGBITMKMPOUTL-VDWUQFQWSA-N- Molecular formula
- C20H24ClNO2
- Average molar mass
- 345.9 g/mol
- Monoisotopic mass
- 345.1495567
Names & identifiers
- Preferred name
- Cyclopropanecarboxylic acid, 1-phenyl-2-(((phenylmethyl)amino)methyl)-, ethyl ester, (Z)-, monohydrochloride
- IUPAC
- benzyl-[[(1S,2R)-2-ethoxycarbonyl-2-phenylcyclopropyl]methyl]azanium chloride
Names & synonyms
85467-32-9Cyclopropanecarboxylic acid, 1-phenyl-2-(((phenylmethyl)amino)methyl)-, ethyl ester, (Z)-, monohydrochloride(Z)-1-Phenyl-2-((phenylmethylamino)methyl)cyclopropanecarboxylic acid ethyl ester HClRefChem:336236
Database identifiers
- CAS
85467-32-9- PubChem CID
- 55339
Properties
Computed structural properties
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 385
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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