1-Amino-3-methylurea - ≥98% , CAS No.17696-95-6

CAS: 17696-95-6 Cat. No.: A478754 Peso molecular: 89.10 Número EC: 803-212-9

GRADE & PURITY ≥98%

Synonyms

4-methylsemicarbazide | AKOS009344134 | LHYKTQVFLKHQSR-UHFFFAOYSA-N | DTXSID60292383 | NSC 82194 | FT-0697840 | EN300-54176 | 3-amino-1-methylurea | NSC82194 | NSC-82194 | A50867 | A881485 | 1-amino-3-methylurea | AMY42564 | SB86394 | n-methylhydrazinecar

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

4-methylsemicarbazide | AKOS009344134 | LHYKTQVFLKHQSR-UHFFFAOYSA-N | DTXSID60292383 | NSC 82194 | FT-0697840 | EN300-54176 | 3-amino-1-methylurea | NSC82194 | NSC-82194 | A50867 | A881485 | 1-amino-3-methylurea | AMY42564 | SB86394 | n-methylhydrazinecar

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

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

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CNC(=O)NN
• IUPAC Name: 1-amino-3-methylurea
• InChIKey: LHYKTQVFLKHQSR-UHFFFAOYSA-N
• INCHI: 1S/C2H7N3O/c1-4-2(6)5-3/h3H2,1H3,(H2,4,5,6)
• Isómeros SMILES: CNC(=O)NN
• Peso molecular: 89.10
• Reaxy-Rn: 1742970
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1742970&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Hydrazines and derivatives

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Hydrazines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Semicarbazides
• Alternative Parents: Organic carbonic acids and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Semicarbazide - Carbonic acid derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as semicarbazides. These are organic compounds containing the semicarbazide functional group with the general structure R1(N)R2NR3C(=O)N(R4)R5 (R1-R5=H, alkyl, aryl), a derivative of urea, where the amine group on one side has been replace by a hydrazine group.
• 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

• Sensibilidad: Light sensitive
• Peso molecular: 89.100 g/mol
• XLogP3: -2.200
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 89.0589 Da
• Monoisotopic Mass: 89.0589 Da
• Topological Polar Surface Area: 67.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 52.800
• 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: 1

Referencias

1. Wang Jiasheng, Zhang Decheng, Xu Keke, Hui Ni, Wang Dongwei.  (2022)  Electrochemical assay of acetamiprid in vegetables based on nitrogen-doped graphene/polypyrrole nanocomposites.  MICROCHIMICA ACTA,  189  (10): (1-9).  [PMID:36169733] [10.1007/s00604-022-05490-4]