4-Phenylpiperazine-1-carbaldehyde

HCID 259459

Notes Reactions

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Basic information

CAS: 51420-33-8
Standard SMILES: O=CN1CCN(c2ccccc2)CC1
InChIKey: ZJQOHRIHVHFULX-UHFFFAOYSA-N
Molecular formula: C11H14N2O
Average molar mass: 190.24 g/mol
Monoisotopic mass: 190.11061307

Names & identifiers

Preferred name: 4-Phenylpiperazine-1-carbaldehyde
IUPAC: 4-phenylpiperazine-1-carbaldehyde

Names & synonyms

4-phenylpiperazine-1-carbaldehyde51420-33-8NSC89416NCIOpen2_001535SCHEMBL2481224SCHEMBL3076371SCHEMBL4052281SCHEMBL81377384-phenyl-1-piperazinecarbaldehydeDTXSID40293419ZJQOHRIHVHFULX-UHFFFAOYSA-NNSC 89416

Show more names

NSC-89416AKOS005067511[4-(phenyl)-piperazin-1-yl]-methanoneF79937AE-641/00613064

Database identifiers

CAS: 51420-33-8
PubChem CID: 259459
DTXSID: DTXSID40293419
Nikkaji: J2.121.437J

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 23.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 182

Related reactions

1 records

New reaction record

HRID 490587As productuspto-grants-2009_05

Compound notes

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