Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(o-methoxyphenyl)-, oxalate
Basic information
- CAS
23904-79-2- Standard SMILES
COc1ccccc1N1CCN(CCOC(c2ccccc2)c2ccc(Cl)cc2)CC1.O=C(O)C(=O)O- InChIKey
FNCPSCUFEVHYTI-UHFFFAOYSA-N- Molecular formula
- C28H31ClN2O6
- Average molar mass
- 527 g/mol
- Monoisotopic mass
- 526.1870644
Names & identifiers
- Preferred name
- Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(o-methoxyphenyl)-, oxalate
- IUPAC
- 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-4-(2-methoxyphenyl)piperazine;oxalic acid
Names & synonyms
23904-79-21-(2-(alpha-(p-Chlorophenyl)benzyloxy)ethyl)-4-(o-methoxyphenyl)piperazine oxalatePiperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(o-methoxyphenyl)-, oxalateRefChem:372004DTXSID90946706Oxalic acid--1-{2-[(4-chlorophenyl)(phenyl)methoxy]ethyl}-4-(2-methoxyphenyl)piperazine (1/1)
Database identifiers
- CAS
23904-79-2- PubChem CID
- 91011
- DTXSID
DTXSID90946706
Properties
Computed structural properties
- Topological polar surface area
- 99.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 571
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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