5'-Formyl-2,2'-bithiophene-5-boronic Acid (contains varying amounts of Anhydride) - ≥95% , CAS No.1369328-62-0

CAS: 1369328-62-0 Cat. No.: F301455 Peso molecular: 238.08 Número EC: 811-036-9

GRADE & PURITY ≥95%

Synonyms

5'-Formyl-2,2'-bithiophene-5-boronic Acid | F0548 | MFCD11973889 | T71738 | (5'-Formyl-[2,2'-bithiophen]-5-yl)boronicacid | [5-(5-formylthiophen-2-yl)thiophen-2-yl]boronic acid | 5'-Formyl-2,2'-bithiophene-5-boronic acid (contains varying amounts of anhyd

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

5'-Formyl-2, 2'-bithiophene-5-boronic Acid | F0548 | MFCD11973889 | T71738 | (5'-Formyl-[2, 2'-bithiophen]-5-yl)boronicacid | [5-(5-formylthiophen-2-yl)thiophen-2-yl]boronic acid | 5'-Formyl-2, 2'-bithiophene-5-boronic acid (contains varying amounts of anhyd

Especificaciones y pureza

≥95%

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

≥95%

Nombres e identificadores

• Pubchem Sid: 504770418
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504770418
• Sonrisas canónicas: B(C1=CC=C(S1)C2=CC=C(S2)C=O)(O)O
• IUPAC Name: [5-(5-formylthiophen-2-yl)thiophen-2-yl]boronic acid
• InChIKey: RDIOTSOSMWVMSX-UHFFFAOYSA-N
• INCHI: 1S/C9H7BO3S2/c11-5-6-1-2-7(14-6)8-3-4-9(15-8)10(12)13/h1-5,12-13H
• Isómeros SMILES: B(C1=CC=C(S1)C2=CC=C(S2)C=O)(O)O
• Peso molecular: 238.08
• Reaxy-Rn: 22795730
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22795730&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Bi- and oligothiophenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Bi- and oligothiophenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Bi- and oligothiophenes
• Alternative Parents: Aryl-aldehydes 2,5-disubstituted thiophenes Heteroaromatic compounds Boronic acids Organic metalloid salts Organometalloid compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Bithiophene - 2,5-disubstituted thiophene - Aryl-aldehyde - Heteroaromatic compound - Thiophene - Boronic acid - Boronic acid derivative - Organic metalloid salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic metalloid moeity - Aldehyde - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as bi- and oligothiophenes. These are organic compounds containing two or more linked thiophene rings. Thiophene is a five-member aromatic ring with one sulfur and four 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: air sensitive;heat sensitive
• Peso molecular: 238.100 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 237.993 Da
• Monoisotopic Mass: 237.993 Da
• Topological Polar Surface Area: 114.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 239.000
• 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

XLogP3