2-(4-Amino-1h-pyrazol-1-yl)ethanol - ≥95% , CAS No.948571-47-9

CAS: 948571-47-9 Cat. No.: A188563 Peso molecular: 127.1

GRADE & PURITY ≥95%

Synonyms

BS-13038 | AMY4662 | 2-(4-aminopyrazolyl)ethan-1-ol | 4-Aminopyrazole-1-ethanol | SY113975 | 4-amino-1H-pyrazole-1-ethanol | SB18304 | 2-(4-amino-pyrazol-1-yl)-ethanol | 2-(4-aminopyrazol-1-yl)ethanol | 2-(4-amino-1H-pyrazol-1-yl)ethan-1-ol | AB01004474-0

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Specifications

Sinónimos

BS-13038 | AMY4662 | 2-(4-aminopyrazolyl)ethan-1-ol | 4-Aminopyrazole-1-ethanol | SY113975 | 4-amino-1H-pyrazole-1-ethanol | SB18304 | 2-(4-amino-pyrazol-1-yl)-ethanol | 2-(4-aminopyrazol-1-yl)ethanol | 2-(4-amino-1H-pyrazol-1-yl)ethan-1-ol | AB01004474-0

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light

Enviado en

Wet ice

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

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 504770090
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504770090
• Sonrisas canónicas: C1=C(C=NN1CCO)N
• IUPAC Name: 2-(4-aminopyrazol-1-yl)ethanol
• InChIKey: AXQLNAAVMSWBEQ-UHFFFAOYSA-N
• INCHI: 1S/C5H9N3O/c6-5-3-7-8(4-5)1-2-9/h3-4,9H,1-2,6H2
• Isómeros SMILES: C1=C(C=NN1CCO)N
• Peso molecular: 127.1
• Reaxy-Rn: 15556763
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15556763&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azoles
      • Subclass Pyrazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azoles
• Subclass: Pyrazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrazoles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Alkanolamines Primary amines Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Pyrazole - Azacycle - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrazoles. These are compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) and three carbon atoms.
• 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: 127.140 g/mol
• XLogP3: -1.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 127.075 Da
• Monoisotopic Mass: 127.075 Da
• Topological Polar Surface Area: 64.099 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 88.300
• 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