CID 657389
Basic information
- CAS
2016-88-8- Standard SMILES
NC(N)=NC(=O)c1nc(Cl)c(N)nc1N.[Cl-].[H+]- InChIKey
ACHKKGDWZVCSNH-UHFFFAOYSA-N- Molecular formula
- C6H9Cl2N7O
- Average molar mass
- 266.09 g/mol
- Monoisotopic mass
- 265.0245633
Overview
See also: Amiloride hydrochloride anhydrous (preferred); Amiloride (has active moiety).
Names & identifiers
- Preferred name
- CID 657389
- IUPAC
- 3,5-diamino-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide;hydron;chloride
- English name
- Amiloride hydrochloride
- Molecular formula
- C6H8ClN7O.ClH
- Molecular weight
- 266.09
Names & synonyms
SCHEMBL136682AKOS015917993AMILORIDE HCLArumilAMipraMiziAMIPRAMIDINamiprazidineAMipraMidineAMIPRAMIZIDEGUANAMPRAZINEamiloridechlorideHCL AMILORIDE HCL
Database identifiers
- CAS
2016-88-8- PubChem CID
- 657389
Properties
Computed structural properties
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 279
Physicochemical properties
- Melting point
- 293 · 293-294°C
- storage temp.
- Store at RT
- solubility
- 2 O: · H2O: 50 mg/mL, clear, yellow-green
- form
- powder
- color
- yellow
- Water Solubility
- 0.1 g/100 · <0.1 g/100 mL at 19.5 ºC
- BCS Class
- 1 · 1
- 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
- InChIKey
- ACHKKGDWZVCSNH-UHFFFAOYSA-N
- SMILES
- C1(N=C(C(N)=NC=1N)Cl)C(=O)NC(=N)N.Cl
- CAS DataBase Reference
- 2016 · 2016-88-8(CAS DataBase Reference)
- FDA UNII
- 7 M458Q65S3 · 7M458Q65S3
- EPA Substance Registry System
- Amiloride hydrochloride (2016-88-8)
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- Protein binding
- 30 · 30-40%
- Excreted unchanged in urine
- 50 % · 50%
- Volume of distribution
- 5 · 5(L/kg)
- Biological half-life
- 6 · 6-20 / 100
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P405-P501
- PPE
- 2 · Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
- Hazard Codes
- T,Xi
- Risk Statements
- 25 · 25-36/37/38
- Safety Statements
- 36 · 36-45-26
- RIDADR
- 2811 · UN 2811 6.1/PG 3
- WGK Germany
- 3 · 3
- RTECS
- 2275500 · UQ2275500
- HazardClass
- 6.1 · 6.1(a)
- PackingGroup
- II
- HS Code
- 29339980 · 29339980
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 Oral · Acute Tox. 3 Oral
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
- wgk
- 3
- rtecs
- UQ2275500
- ridadr
- UN 2811 6.1/PG 3
- hs_code
- 29339980
- risk_code
- 25-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T,Xi
- safety_code
- 36-45-26
- hazard_class
- 6.1(a)
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- packing_group
- II
- Hazard statements
- H301
- Hazard Classifications
- Acute Tox. 3 Oral
- Precautionary statements
- P264-P270-P301+P310-P405-P501
Chemistry & industry
Applications
UsesNa+ channel inhibitor, diuretic
UsesA calcium channel andsodium channel protein inhibitor
General DescriptionCrystalline solid or very light yellow powder.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Amiloride hydrochloride is a hydrochloride obtained by combining amiloride with one molar equivalent of hydrochloric acid. It has a role as a diuretic and a sodium channel blocker. It contains an amiloride(1+).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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