4-hexylresorcinol

Synonyms: "hexylresorcinol", "p-hexylresorcinol", "4-hexylbenzene-1,3-diol", "antascarin", "adrover", "ascaricid", "ascarinol", "caprokol"

Source: 4-hexylresorcinol is a food additive for use in uncooked crustacea. This chemical also has anesthetic, antiseptic and antihelminthic properties.

Identifiers:

IUPAC Name: 4-hexylbenzene-1,3-diol
CAS Number: 136-77-6
PubChem ID: 3610
InChiKey: WFJIVOKAWHGMBH-UHFFFAOYSA-N
Canonical SMILES: CCCCCCC1=C(C=C(C=C1)O)O

Structural Properties:

Molecular Formula: C₁₂H₁₈O₂
Molecular Weight: 194.270

Pharmacophore Features:

Number of bond donors: 2
Number of bond acceptors: 2
Number of atoms different from hydrogen: 14

Downloads

2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

Search Similar molecules

Similarity from: % to %

External Links