Basic information
- CAS
6935-82-6- Standard SMILES
O=CN1CCN(Cc2ccccc2)CC1- InChIKey
UPRPMAXKKSSVTD-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- 4-Benzylpiperazine-1-carbaldehyde
- IUPAC
- 4-benzylpiperazine-1-carbaldehyde
Names & synonyms
4-benzylpiperazine-1-carbaldehyde6935-82-6DTXSID90283603RefChem:290359DTXCID70234754NSC32366SCHEMBL1134937SCHEMBL1134938SCHEMBL7619687SCHEMBL7677285NSC-32366AKOS009067841
Database identifiers
- CAS
6935-82-6- PubChem CID
- 233602
- DTXSID
DTXSID90283603- Nikkaji
- J3.468.132E
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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