1-Piperazineacetic acid, 4-(p-chlorocinnamoyl)-, ethyl ester, hydrochloride
Basic information
- CAS
26219-24-9- Standard SMILES
CCOC(=O)CN1CCN(C(=O)/C=C/c2ccc(Cl)cc2)CC1.Cl- InChIKey
DMQRGZOQWOCULC-HAAWTFQLSA-N- Molecular formula
- C17H22Cl2N2O3
- Average molar mass
- 373.3 g/mol
- Monoisotopic mass
- 372.100748
Names & identifiers
- Preferred name
- 1-Piperazineacetic acid, 4-(p-chlorocinnamoyl)-, ethyl ester, hydrochloride
- IUPAC
- ethyl 2-[4-[(E)-3-(4-chlorophenyl)prop-2-enoyl]piperazin-1-yl]acetate;hydrochloride
Names & synonyms
1-Piperazineacetic acid, 4-(p-chlorocinnamoyl)-, ethyl ester, hydrochloride26219-24-9RefChem:10564374-(p-Chlorocinnamoyl)-1-piperazineacetic acid ethyl ester hydrochloride
Database identifiers
- CAS
26219-24-9- PubChem CID
- 6445261
Properties
Computed structural properties
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 426
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Compound notes
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