Metformin-d6, Hydrochloride - ≥98 atom% D,≥98% , CAS No.1185166-01-1

CAS: 1185166-01-1 Cat. No.: M357600 Molecular Weight: 171.66 EC Number: 802-488-8

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

N,N-Dimethylimidodicarbonimidic Diamide-d6, Hydrochloride | 1,1-Dimethylbiguanide-d6 (hydrochloride) | AS-6062 | N,N-Di(methyl-d3)imidodicarbonimidic diamide hydrochloride | Metformin-d6, Hydrochloride | Metformin D6 Hydrochloride | HY-110228 | 1-[(diamin

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Metformin-d6, Hydrochloride is an oral hypoglycemic agent.

Specifications

Synonyms

N, N-Dimethylimidodicarbonimidic Diamide-d6, Hydrochloride | 1, 1-Dimethylbiguanide-d6 (hydrochloride) | AS-6062 | N, N-Di(methyl-d3)imidodicarbonimidic diamide hydrochloride | Metformin-d6, Hydrochloride | Metformin D6 Hydrochloride | HY-110228 | 1-[(diamin

Specifications & Purity

≥98 atom% D, ≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98 atom% D, ≥98%

Names and Identifiers

• Pubchem Sid: 488201117
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488201117
• Canonical Smiles: CN(C)C(=N)N=C(N)N.Cl
• IUPAC Name: 3-(diaminomethylidene)-1,1-bis(trideuteriomethyl)guanidine;hydrochloride
• InChIKey: OETHQSJEHLVLGH-TXHXQZCNSA-N
• INCHI: 1S/C4H11N5.ClH/c1-9(2)4(7)8-3(5)6;/h1-2H3,(H5,5,6,7,8);1H/i1D3,2D3
• Isomeric SMILES: [2H]C([2H])([2H])N(C(=N)N=C(N)N)C([2H])([2H])[2H].Cl
• RTECS: DU1800000
• Molecular Weight: 171.66
• Reaxy-Rn: 19872484
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19872484&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Guanidines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Guanidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Biguanides
• Alternative Parents: Tertiary amines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Imines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Biguanide - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrocarbon derivative - Hydrochloride - Imine - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as biguanides. These are organic compounds containing two N-linked guanidines.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: Soluble in DMSO, and methanol.
• Melt Point(°C): 215-218°C (lit.)
• Molecular Weight: 171.660 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 171.116 Da
• Monoisotopic Mass: 171.116 Da
• Topological Polar Surface Area: 91.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 132.000
• Isotope Atom Count: 6
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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