Methylguanidine hydrochloride - ≥98% , CAS No.21770-81-0

CAS: 21770-81-0 Cat. No.: M473051 Peso molecular: 109.56 Beilstein Registry Number: 4(2)571 Número EC: 678-598-3

GRADE & PURITY ≥98%

Synonyms

1-Methylguanidine hydrochloride(1:x) | AI3-51270 | EN300-7386262 | STK084272 | 1-Methylguanidinehydrochloride | AKOS025404541 | CHEBI:189433 | N-Methylguanidine hydrochloride | AM20090228 | Methylguanidine hydrochloride | Methylguanidine hydrochloride (1:

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Descripción general

Description

Methylguanidine hydrochloride can be used to prepare:Biaryl derivatives as BACE1 inhibitors.Modified xylose, which is used in the synthesis of biodegradable composite hydrogels.Methylguanidinium borohydride ionic liquid, which is applicable as a hydrogen storage material.

Specifications

Sinónimos

1-Methylguanidine hydrochloride(1:x) | AI3-51270 | EN300-7386262 | STK084272 | 1-Methylguanidinehydrochloride | AKOS025404541 | CHEBI:189433 | N-Methylguanidine hydrochloride | AM20090228 | Methylguanidine hydrochloride | Methylguanidine hydrochloride (1:

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at -20°C, Argon charged

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488188207
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188207
• Sonrisas canónicas: CN=C(N)N.Cl
• IUPAC Name: 2-methylguanidine;hydrochloride
• InChIKey: VJQCNCOGZPSOQZ-UHFFFAOYSA-N
• INCHI: 1S/C2H7N3.ClH/c1-5-2(3)4;/h1H3,(H4,3,4,5);1H
• Isómeros SMILES: CN=C(N)N.Cl
• WGK Alemania: 3
• RTECS: MF3990000
• Peso molecular: 109.56
• Beilstein: 4(2)571
• Reaxy-Rn: 6212283
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6212283&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Guanidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Guanidines
• Alternative Parents: Carboximidamides Organopnictogen compounds Organic chloride salts Imines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Guanidine - Carboximidamide - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Imine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as guanidines. These are compounds containing a guanidine moiety, with the general structure (R1R2N)(R3R4N)C=N-R5.
• 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

Propiedades químicas y físicas

• Solubilidad: water: soluble 50mg/mL, clear
• Sensibilidad: Hygroscopic
• Peso molecular: 109.560 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 109.041 Da
• Monoisotopic Mass: 109.041 Da
• Topological Polar Surface Area: 64.400 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 42.900
• 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

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