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Amiloride hydrochloride

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Name

Amiloride hydrochloride

EINECS 217-958-2
CAS No. 2016-88-8 Density 2.11 g/cm3
PSA 156.79000 LogP 2.07300
Solubility <0.1 g/100 mL at 19.5 °C in water Melting Point 293-294 °C
Formula C6H8ClN7O.HCl Boiling Point 628.1 °C at 760 mmHg
Molecular Weight 266.09 Flash Point 333.7 °C
Transport Information UN 2811 6.1/PG 3 Appearance Pale yellow solid
Safety 36-45-26 Risk Codes 25-36/37/38
Molecular Structure Molecular Structure of 2016-88-8 (Amiloride hydrochloride) Hazard Symbols ToxicT,IrritantXi
Synonyms

Pyrazinecarboxamide,3,5-diamino-N-(aminoiminomethyl)-6-chloro-, monohydrochloride (9CI);Pyrazinecarboxamide, N-amidino-3,5-diamino-6-chloro-, monohydrochloride (8CI);1-(3,5-Diamino-6-chloropyrazinecarboxyl)guanidine hydrochloride;Amiloridhydrochloride;Guanamprazine hydrochloride;N-Amidino-3,5-diamino-6-chloropyrazinamide hydrochloride;N-Amidino-3,5-diamino-6-chloropyrazinecarboxamide hydrochloride;

Article Data 3

Amiloride hydrochloride Synthetic route

2016-88-8

amiloride hydrochloride

5998-26-5

C6H9N7O*ClH

Conditions
ConditionsYield
With palladium on activated charcoal; hydrogen; magnesium oxide59%
2016-88-8

amiloride hydrochloride

137053-86-2

Amiloride

Disodium N-[(3,5-diamino-6-chloropyrazinamido)imino-methyl]phosphoramidate monohydrate

Conditions
ConditionsYield
With sodium hydroxide; trichlorophosphate In pyridine
2016-88-8

amiloride hydrochloride

N-amidino-3,5-diamino-6-iodo-2-pyrazinecarboxamide hydrochloride

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: palladium on activated charcoal; hydrogen; magnesium oxide
2: N-iodo-succinimide
View Scheme
2016-88-8

amiloride hydrochloride

1345839-34-0

C6H8BrN7O*ClH

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: palladium on activated charcoal; hydrogen; magnesium oxide
2: N-Bromosuccinimide
View Scheme

Amiloride hydrochloride Specification

The Amiloride hydrochloride, with the CAS registry number 2016-88-8, is also known as Pyrazinecarboxamide, 3,5-diamino-N-(aminoiminomethyl)-6-chloro-, monohydrochloride. It belongs to the product categories of Active Pharmaceutical Ingredients; Ion Transporter and Other Ion Channel; Ion Channels; Amines; Bases & Related Reagents; Heterocycles; Intermediates & Fine Chemicals; Nucleotides; Pharmaceuticals. Its EINECS registry number is 217-958-2. This chemical's molecular formula is C6H8ClN7O·ClH and molecular weight is 266.09. What's more, both its IUPAC name and systematic name are the same which is called 3,5-Diamino-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide hydrochloride. It should be stored in a cool, dry and well-ventilated place. It can be used as an antikaliuretic-diuretic agent.

Physical properties about Amiloride hydrochloride are: (1)ACD/LogP: 2.065; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.06; (4)ACD/LogD (pH 7.4): 2.06; (5)ACD/BCF (pH 5.5): 21.82; (6)ACD/BCF (pH 7.4): 21.83; (7)ACD/KOC (pH 5.5): 316.14; (8)ACD/KOC (pH 7.4): 316.33; (9)#H bond acceptors: 8; (10)#H bond donors: 8; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 68.17 Å2; (13)Flash Point: 333.7 °C; (14)Enthalpy of Vaporization: 92.95 kJ/mol; (15)Boiling Point: 628.1 °C at 760 mmHg; (16)Vapour Pressure: 1.08E-15 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes and at low levels cause damage to health. In addition, it is toxic if swallowed and irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. And in case of accident or if you feel unwell seek medical advice immediately.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1nc(C(=O)\N=C(/N)N)c(nc1N)N.Cl
(2) InChI: InChI=1S/C6H8ClN7O.ClH/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11;/h(H4,8,9,13)(H4,10,11,14,15);1H
(3) InChIKey: ACHKKGDWZVCSNH-UHFFFAOYSA-N

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