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4755-59-3

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Basic Information
CAS No.: 4755-59-3
Name: Clodazon
Molecular Structure:
Molecular Structure of 4755-59-3 (Clodazon)
Formula: C18H20 Cl N3 O
Molecular Weight: 329.829
Synonyms: 2-Benzimidazolinone,5-chloro-1-[3-(dimethylamino)propyl]-3-phenyl- (7CI,8CI); Clodazon
Density: 1.232g/cm3
Boiling Point: 466.3°Cat760mmHg
Flash Point: 235.8°C
Safety: Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of Cl− and NOx.
PSA: 30.17000
LogP: 3.39730
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Chemistry

IUPAC Name: 5-Chloro-1-[3-(dimethylamino)propyl]-3-phenylbenzimidazol-2-one
Synonyms of Clodazone (CAS NO.4755-59-3) : 5-Chloro-1-(3-(dimethylamino)propyl)-3-phenyl-2-benzimidazolinone ; Clodazon ; Clodazona ; Clodazonum ; 2-Benzimidazolinone, 5-chloro-1-(3-(dimethylamino)propyl)-3-phenyl- ; 2H-Benzimidazol-2-one, 5-chloro-1-(3-(dimethylamino)propyl)-1,3-dihydro-3-phenyl- (9CI)
InChI:InChI=1/C18H20ClN3O/c1-20(2)11-6-12-21-16-10-9-14(19)13-17(16)22(18(21)23)15-7-4-3-5-8-15/h3-5,7-10,13H,6,11-12H2,1-2H3
CAS NO:4755-59-3
Molecular Formula:C18H20ClN3O
Molecular Weight :329.8239
Molecular Structure :
Index of Refraction: 1.609
Surface Tension: 48.9 dyne/cm
Density: 1.232 g/cm3
Flash Point: 235.8 °C
Enthalpy of Vaporization: 72.8 kJ/mol
Boiling Point: 466.3 °C at 760 mmHg
Vapour Pressure: 7.17E-09 mmHg at 25°C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 505mg/kg (505mg/kg)   International Pharmacopsychiatry. Vol. 1, Pg. 214, 1968.
mouse LD50 intravenous 90mg/kg (90mg/kg)   International Pharmacopsychiatry. Vol. 1, Pg. 214, 1968.
mouse LD50 oral 715mg/kg (715mg/kg)   International Pharmacopsychiatry. Vol. 1, Pg. 214, 1968.
rat LD50 intraperitoneal 142mg/kg (142mg/kg)   International Pharmacopsychiatry. Vol. 1, Pg. 214, 1968.
rat LD50 intravenous 77mg/kg (77mg/kg)   International Pharmacopsychiatry. Vol. 1, Pg. 214, 1968.
rat LD50 oral 2gm/kg (2000mg/kg)   International Pharmacopsychiatry. Vol. 1, Pg. 214, 1968.

Safety Profile

Poison by intravenous and intraperitoneal routes. Moderately toxic by ingestion. When Clodazone (CAS NO.4755-59-3) is heated to decomposition, it emits toxic fumes of Cl− and NOx.