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53716-50-0

Basic Information
CAS No.: 53716-50-0
Name: Oxfendazole
Molecular Structure:
Molecular Structure of 53716-50-0 (Oxfendazole)
Formula: C15H13N3O3S
Molecular Weight: 315.35
Synonyms: 5-Phenylsulfinyl-2-carbomethoxyaminobenzimidazole;Oxfendazole [USAN:BAN:INN];Carbamic acid,[5-(phenylsulfinyl)-1Hbenzimidazol- 2-yl]-,methyl ester;Methyl 5-(phenylsulfinyl)-2-benzimidazolecarbamate;Repidose;methyl [5-(phenylsulfinyl)-1H-benzimidazol-2-yl]carbamate;Oxfendazolum [INN-Latin];Synanthic;(5-(Phenylsulfinyl)-1H-benzimidazol-2-yl)carbamic acid methyl ester;Oxfendazol [INN-Spanish];OFDZ;2-Benzimidazolecarbamic acid, 5-(phenylsulfinyl)-, methyl ester;RS 8858;HOE 8105;RS-8858;[5-(Phenylsulfinyl)-1H-benzimidazol-2-yl]carbamic acid methyl ester;Systamex;methyl N-[5-(benzenesulfinyl)-3H-benzoimidazol-2-yl]carbamate;Fenbendazole sulfoxide;
EINECS: 258-714-5
Density: 1.5 g/cm3
Melting Point: 253oC
Boiling Point:
Flash Point:
Solubility:
Appearance: COA
Hazard Symbols:
Risk Codes: 36
Safety: 26
Transport Information:
PSA: 103.29000
LogP: 3.84660
Raw Materials
43210-67-9
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Chemistry

Molecular Structure of Oxfendazole (CAS NO.53716-50-0):

IUPAC Name: methyl N-[6-(Benzenesulfinyl)-1H-benzimidazol-2-yl]carbamate
Canonical SMILES: COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)C3=CC=CC=C3
InChI: InChI=1S/C15H13N3O3S/c1-21-15(19)18-14-16-12-8-7-11(9-13(12)17-14)22(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
InChIKey: BEZZFPOZAYTVHN-UHFFFAOYSA-N
Molecular Weight: 315.34702 [g/mol]
Molecular Formula: C15H13N3O3S
XLogP3: 2.3
H-Bond Donor: 2
H-Bond Acceptor: 4 
EINECS: 258-714-5
Product Categories: Metabolites; Veterinaries 
storage temp.: 2-8 °C
Appearance: white to yellowish powder
Melting Point: 253 °C 
Index of Refraction: 1.735
Molar Refractivity: 84.37 cm3
Molar Volume: 210.1 cm3
Surface Tension: 88.4 dyne/cm
Density: 1.5 g/cm3
Classification Code: Anthelmintic; Anthelmintics; Anti-Infective Agents; Antinematodal agents; Antiparasitic Agents; Drug / Therapeutic Agent; Mutation data; Reproductive Effect

Uses

 Oxfendazole (CAS NO.53716-50-0) is used as a metabolite of Fenbendazole.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 unreported > 1600mg/kg (1600mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 1164, 1975.
mouse LD50 unreported > 6400mg/kg (6400mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 1164, 1975.
rat LD50 unreported > 6400mg/kg (6400mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 1164, 1975.

Safety Profile

Safety Information of Oxfendazole (CAS NO.53716-50-0):
WGK Germany: 3
RTECS: FD0835000

Specification

 Oxfendazole (CAS NO.53716-50-0), its Synonyms are (5-(Phenylsulfinyl)-1H-benzimidazol-2-yl)carbamic acid methyl ester ; 2-Benzimidazolecarbamic acid, 5-(phenylsulfinyl)-, methyl ester ; 5-(Phenylsulfinyl)-2-benzimidazolecarbamic acid methyl ester ; 5-Phenylsulfinyl-2-carbomethoxyaminobenzimidazole ; Carbamic acid, (5-(phenylsulfinyl)-1H-benzimidazol-2-yl)-, methyl ester ; Carbamic acid, 5-(phenylsulfinyl)-1H-benzimidazol-2-yl-, methyl ester ; Methyl (5-phenylsulfinyl)-1H-benzimidazol-2-yl carbamate ; Methyl 5-(phenylsulfinyl)-2-benzimidazolecarbamate ; Repidose ; Synanthic .