4-Amino-2-bromophenol - ≥97% , CAS No.16750-67-7

CAS: 16750-67-7 Cat. No.: A124279 Peso molecular: 188.02 Beilstein Registry Number: 2802564 Número EC: 685-751-8

GRADE & PURITY ≥97%

Synonyms

BP-11304 | CL8495 | SY050489 | AN-584/43422701 | 4-Amino-2-bromophenol, 97% | 2-bromo-p-aminophenol | MFCD06656565 | BCP17497 | Phenol, 4-amino-2-bromo- | A925918 | EN300-185502 | J-010374 | 4-Amino-2-bromopheno | AS-19223 | 2-Bromo-4-aminophenol | SCHEMB

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

BP-11304 | CL8495 | SY050489 | AN-584/43422701 | 4-Amino-2-bromophenol, 97% | 2-bromo-p-aminophenol | MFCD06656565 | BCP17497 | Phenol, 4-amino-2-bromo- | A925918 | EN300-185502 | J-010374 | 4-Amino-2-bromopheno | AS-19223 | 2-Bromo-4-aminophenol | SCHEMB

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, 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

≥97%

Nombres e identificadores

• Pubchem Sid: 488198662
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488198662
• Sonrisas canónicas: C1=CC(=C(C=C1N)Br)O
• IUPAC Name: 4-amino-2-bromophenol
• InChIKey: CBQJZWGBFZAUEV-UHFFFAOYSA-N
• INCHI: 1S/C6H6BrNO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H,8H2
• Isómeros SMILES: C1=CC(=C(C=C1N)Br)O
• WGK Alemania: 3
• Peso molecular: 188.02
• Beilstein: 2802564
• Reaxy-Rn: 2802564
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2802564&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Phenols
      • Subclass Halophenols
        • Level5 Bromophenols
          • Level6 O-bromophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Bromophenols
• Direct Parent: O-bromophenols
• Alternative Parents: p-Aminophenols Aniline and substituted anilines Bromobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Primary amines Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminophenol - P-aminophenol - Aniline or substituted anilines - 2-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as o-bromophenols. These are bromophenols carrying a iodine at the C2 position of the benzene ring.
• 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: Very slightly soluble in Methanol
• Sensibilidad: Air & Carbon dioxide Sensitive
• Punto de fusión (°C): 163 °C(dec.)
• Peso molecular: 188.020 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 186.963 Da
• Monoisotopic Mass: 186.963 Da
• Topological Polar Surface Area: 46.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 99.100
• 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