Benzocaine

Synonyms: benzocaine, "Ethyl 4-aminobenzoate", "Ethyl aminobenzoate", "Ethyl p-aminobenzoate", "Americaine", "Anesthesin", "Parathesin", "Anaesthesin", "Ethoform", "Norcaine", "Orthesin", "Amben ethyl ester", "p-Carbethoxyaniline", "4-Aminobenzoic acid ethyl ester", "Parathesine", "Dermoplast", "Hurricaine", "Anaesthin", "Identhesin", "Anesthesine", "Anestezin", "Anesthone", "Keloform", "Norcain", "Topcaine", "Anaesthan-syngala", "Ora-jel", "Solarcaine", "Solu H", "p-Ethoxycarboxylic aniline", "Baby Anbesol", "4-Carbethoxyaniline", "p-(Ethoxycarbonyl)aniline", "Benzocainum"

Source: Benzocaine is an effective anesthetic agent.

Identifiers:

IUPAC Name: ethyl 4-aminobenzoate
CAS Number: 94-09-7
PubChem ID: 2337
InChiKey: BLFLLBZGZJTVJG-UHFFFAOYSA-N
Canonical SMILES: CCOC(=O)C1=CC=C(C=C1)N

Structural Properties:

Molecular Formula: C₉H₁₁NO₂
Molecular Weight: 165,190

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 12

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Evidence Supporting This Chemical as an Emerging Contaminant

Banjac, Z., Ginebreda, A., Kuzmanovic, M., Marc?, R., Nadal, M., Riera, J. M., & Barcel?, D. (2015). Emission factor estimation of ca. 160 emerging organic microcontaminants by inverse modeling in a Mediterranean river basin (Llobregat, NE Spain). Science of the Total Environment, 520, 241-252.

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