Biguanidehydrochloride - ≥97% , CAS No.4761-93-7

CAS: 4761-93-7 Cat. No.: B303787 Summenformel: C₂H₈ClN₅ Molekulargewicht: 137.57

GRADE & PURITY ≥97%

Synonyms

J-200197 | imidodicarbonimidic diamide hydrochloride | Biguanidehydrochloride | F20461 | A827283 | Imidodicarbonimidic diamide, monohydrochloride | FT-0657095 | Triimidodicarbonic diamide--hydrogen chloride (1/1) | 1-(diaminomethylidene)guanidine;hydrochl

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

J-200197 | imidodicarbonimidic diamide hydrochloride | Biguanidehydrochloride | F20461 | A827283 | Imidodicarbonimidic diamide, monohydrochloride | FT-0657095 | Triimidodicarbonic diamide--hydrogen chloride (1/1) | 1-(diaminomethylidene)guanidine;hydrochl

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

Pubchem Sid

504766992

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504766992

Kanonisches Lächeln

C(=NC(=N)N)(N)N.Cl

IUPAC Name

1-(diaminomethylidene)guanidine;hydrochloride

InChIKey

FKPUYTAEIPNGRM-UHFFFAOYSA-N

INCHI

1S/C2H7N5.ClH/c3-1(4)7-2(5)6;/h(H7,3,4,5,6,7);1H

Isomere SMILES

C(=NC(=N)N)(N)N.Cl

Molekulargewicht

137.57

Reaxy-Rn

9504857

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9504857&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Guanidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Biguanides
• Alternative Parents: Quaternary ammonium salts Propargyl-type 1,3-dipolar organic compounds Carboximidamides Organopnictogen compounds Organic chloride salts Imines Hydrocarbon derivatives Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Biguanide - Quaternary ammonium salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Imine - Organic cation - Aliphatic acyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 137.570 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 137.047 Da
• Monoisotopic Mass: 137.047 Da
• Topological Polar Surface Area: 114.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 98.600
• Isotope Atom Count: 0
• 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

XLogP3