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Name	Quinapril hydrochloride	EINECS	620-479-5
CAS No.	82586-55-8	Density	N/A
PSA	95.94000	LogP	3.69790
Solubility	N/A	Melting Point	120-130 °C
Formula	C₂₅H₃₁ClN₂O₅	Boiling Point	662 °C at 760 mmHg
Molecular Weight	474.985	Flash Point	354.1 °C
Transport Information	N/A	Appearance	white crystalline solid
Safety	22-24/25	Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	3-Isoquinolinecarboxylicacid,2-[(2S)-2-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-,monohydrochloride, (3S)- (9CI);Accupril;Accuprin;Accupro;Accupro20;Accupron;Acequide;Acequin;Acuitel;Acuprel;Acupril;Asig;CI 906;Korec;Korectic;PD 109452-2;3-Isoquinolinecarboxylicacid,2-[(2S)-2-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-,hydrochloride (1:1), (3S)-;Quinazil;Quinopril;	Article Data	6

Quinapril hydrochloride Chemical Properties

Molecule structure of Quinapril hydrochloride (CAS NO.82586-55-8):

IUPAC Name: (3S)-2-[(2S)-2-[[(2S)-1-Ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid hydrochloride
Molecular Weight: 474.97704 g/mol
Molecular Formula: C₂₅H₃₁ClN₂O₅
Melting Point: 120-130 °C
Flash Point: 354.1 °C
Enthalpy of Vaporization: 102.32 kJ/mol
Boiling Point: 662 °C at 760 mmHg
Vapour Pressure: 2E-18 mmHg at 25 °C
Storage Temp.: 2-8 °C
H-Bond Donor: 3
H-Bond Acceptor: 6
Rotatable Bond Count: 10
Exact Mass: 474.19215
MonoIsotopic Mass: 474.19215
Topological Polar Surface Area: 95.9
Heavy Atom Count: 33
Canonical SMILES: CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CC3=CC=CC=C3CC2C(=O)O.Cl
Isomeric SMILES: CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=CC=CC=C3C[C@H]2C=O)O.Cl
InChI: InChI=1S/C25H30N2O5.ClH/c1-3-32-25(31)21(14-13-18-9-5-4-6-10-18)26-17(2)23(28)27-16-20-12-8-7-11-19(20)15-22(27)24(29)30;/h4-12,17,21-22,26H,3,13-16H2,1-2H3,(H,29,30);1H/t17-,21-,22-;/m0./s1
InChIKey: IBBLRJGOOANPTQ-JKVLGAQCSA-N
Product Categories: Active Pharmaceutical Ingredients;APIs;Intermediates & Fine Chemicals;Pharmaceuticals;Steroids

Quinapril hydrochloride Uses

Quinapril hydrochloride (CAS NO.82586-55-8) is used in the treatment of hypertension and congestive heart failure.

Quinapril hydrochloride Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Source
dog	LD	oral	> 500mg/kg (500mg/kg)	Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 26, Pg. 740, 1995.
mouse	LD50	intravenous	504mg/kg (504mg/kg)	Angiology. Vol. 40, Pg. 335, 1989.
mouse	LD50	oral	1739mg/kg (1739mg/kg)	Angiology. Vol. 40, Pg. 335, 1989.
rat	LD50	intravenous	107mg/kg (107mg/kg)	Angiology. Vol. 40, Pg. 335, 1989.
rat	LD50	oral	3541mg/kg (3541mg/kg)	Angiology. Vol. 40, Pg. 335, 1989.

Quinapril hydrochloride Safety Profile

Safety Statements: 22-24/25
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
RTECS; NW7176000

Quinapril hydrochloride Specification

Quinapril hydrochloride (CAS NO.82586-55-8) is also named as (S)-2-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid, 1-ethyl ester, monohydrochloride ; 3-Isoquinolinecarboxylic acid, 2-(2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)-1,2,3,4-tetrahydro-, monohydrochloride, (3S-(2(R*(R*)),3R*)) ; Accupril ; Accuprin ; Accupron ; Acequin ; Acuitel ; Acuprel ; Asig ; CI906 ; Conan ; Continucor ; Ectren ; HSDB 7046 ; Hemokvin ; Korec ; Koretic ; Lidaltrin ; PD 109452-2 ; Quinapril ; Quinapril HCl ; Quinazil ; UNII-33067B3N2M . Quinapril hydrochloride (CAS NO.82586-55-8) is white crystalline solid.

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