denatonium benzoate (Bitrex) Report issue

Small molecule Experimental
AACT MeSH PubChem

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Chemistry

Mol. Mass

325.4678

ALogP

4.3

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC[N+](CC)(CC(=O)NC1=C(C)C=CC=C1C)CC2=CC=CC=C2
  • InChIKey: ZFQMTVNLDNXRNQ-UHFFFAOYSA-O
    1S/C21H28N2O/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4/h7-14H,5-6,15-16H2,1-4H3/p+1
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1371493   ChEMBL
denatonium benzoate

CHEMBL1738972   ChEMBL
denatonium

4IK22DF4OU   NCATS
denatonium *

Denatonium   Wikipedia

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