triclocarban

Synonyms: cutisan, "solubacter", "trilocarban", "3,4,4'-trichlorocarbanilide", "trichlocarban", "triclocarbanum", "cusiter", "genoface", "procutene"

Source: triclocarban is an antimicrobial active ingredient used globally in a wide range of personal cleansing products including deodorant soaps, deodorants, detergents, cleansing lotions, wipes and bar soaps.

Identifiers:

IUPAC Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)urea
CAS Number: 101-20-2
PubChem ID: 7547
InChiKey: ICUTUKXCWQYESQ-UHFFFAOYSA-N
Canonical SMILES: C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl

Structural Properties:

Molecular Formula: C₁₃H₉Cl₃N₂O
Molecular Weight: 315.58

Pharmacophore Features:

Number of bond donors: 2
Number of bond acceptors: 1
Number of atoms different from hydrogen: 19

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Evidence Supporting This Chemical as an Emerging Contaminant

Montes-Grajales, D., Fennix-Agudelo, M., & Miranda-Castro, W. (2017). Occurrence of personal care products as emerging chemicals of concern in water resources: A review. Science of the Total Environment, 595, 601-614.

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2D-structure

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