Basic information
- Standard SMILES
Cl.O=C(OCc1ccc(Cl)cc1)N1CCNCC1- InChIKey
NBWRWZRKOWQGHR-UHFFFAOYSA-N- Molecular formula
- C12H16Cl2N2O2
- Average molar mass
- 291.17 g/mol
Names & identifiers
- Preferred name
- 4-Chlorobenzyl piperazine-1-carboxylate hydrochloride
- IUPAC
- (4-chlorophenyl)methyl piperazine-1-carboxylate;hydrochloride
Names & synonyms
SCHEMBL357497NBWRWZRKOWQGHR-UHFFFAOYSA-N4-chlorobenzyl piperazine-1-carboxylate hydrochloride
Database identifiers
- PubChem CID
- 66664396
Properties
Computed structural properties
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 249
Related reactions
1 records
Compound notes
Loading…