Propan-2-yl 2-(aminomethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxylate--hydrogen chloride (1/1)
Basic information
- CAS
105310-30-3- Standard SMILES
CC(C)OC(=O)[C@]1(c2ccc(Cl)cc2)C[C@@H]1C[NH3+].[Cl-]- InChIKey
OYJJYVNQJPKLIY-GGMFNZDASA-N- Molecular formula
- C14H19Cl2NO2
- Average molar mass
- 304.2 g/mol
- Monoisotopic mass
- 303.0792842
Names & identifiers
- Preferred name
- Propan-2-yl 2-(aminomethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxylate--hydrogen chloride (1/1)
- IUPAC
- [(1S,2R)-2-(4-chlorophenyl)-2-propan-2-yloxycarbonylcyclopropyl]methylazanium chloride
Names & synonyms
105310-30-3DTXSID80909421Propan-2-yl 2-(aminomethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxylate--hydrogen chloride (1/1)RefChem:1096668DTXCID401338484Cyclopropanecarboxylic acid, 2-(aminomethyl)-1-(p-chlorophenyl)-, 1-methylethyl ester, (Z)-, monohydrochloride(Z)-2-(Aminomethyl)-1-(p-chlorophenyl)cyclopropanecarboxylic acid 1-methylethyl ester HCl
Database identifiers
- CAS
105310-30-3- PubChem CID
- 59922
Properties
Computed structural properties
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 313
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Compound notes
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