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80830-42-8

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Basic Information
CAS No.: 80830-42-8
Name: Rentiapril
Article Data: 4
Molecular Structure:
Molecular Structure of 80830-42-8 (Rentiapril)
Formula: C13H15 N O4 S2
Molecular Weight: 313.398
Synonyms: 4-Thiazolidinecarboxylicacid, 2-(2-hydroxyphenyl)-3-(3-mercapto-1-oxopropyl)-, (2R-cis)-; Fentiapril;Rentiapril; SA 446
Density: 1.451g/cm3
Melting Point: 147°C (rough estimate)
Boiling Point: 553.7°C at 760 mmHg
Flash Point: 288.7°C
PSA: 141.94000
LogP: 1.67720
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Chemistry

IUPAC Name: (2R,4R)-2-(2-Hydroxyphenyl)-3-(3-sulfanylpropanoyl)-1,3-thiazolidine-4-carboxylic acid
Synonyms of Fentiapril (CAS NO.80830-42-8) : (2R,4R)-2-(o-Hydroxyphenyl)-3-(3-mercaptopropionyl)-4-thiazolidinecarboxylic acid ; Prescrin ; Rentiapril ; Rentiaprilum ; 4-Thiazolidinecarboxylic acid, 2-(2-hydroxyphenyl)-3-(3-mercapto-1-oxopropyl)-, (2R-cis)-
InChI: InChI=1/C13H15NO4S2/c15-10-4-2-1-3-8(10)12-14(11(16)5-6-19)9(7-20-12)13(17)18/h1-4,9,12,15,19H,5-7H2,(H,17,18)/t9-,12+/m0/s1
CAS NO:80830-42-8
Molecular Formula:C13H15NO4S2
Molecular Weight :313.3925
Molecular Structure :
Index of Refraction: 1.66
Surface Tension: 70.1 dyne/cm
Density: 1.451 g/cm3
Flash Point: 288.7 °C
Enthalpy of Vaporization: 87.82 kJ/mol
Boiling Point: 553.7 °C at 760 mmHg
Vapour Pressure: 4.29E-13 mmHg at 25°C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 200mg/kg (200mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
mouse LD50 intravenous 946mg/kg (946mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

LUNGS, THORAX, OR RESPIRATION: CYANOSIS

BEHAVIORAL: ATAXIA		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
mouse LD50 oral 8050mg/kg (8050mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
mouse LD50 subcutaneous 2213mg/kg (2213mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

LUNGS, THORAX, OR RESPIRATION: CYANOSIS

BEHAVIORAL: ATAXIA		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
rat LD50 intraperitoneal 921mg/kg (921mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
rat LD50 intravenous 884mg/kg (884mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
rat LD50 oral 8290mg/kg (8290mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.
rat LD50 subcutaneous 1369mg/kg (1369mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS		 Oyo Yakuri. Pharmacometrics. Vol. 31, Pg. 235, 1986.