2,6-Dibromobenzaldehyde - ≥98%(GC) , CAS No.67713-23-9

CAS: 67713-23-9 Cat. No.: D154275 Fórmula: C₇H₄Br₂O Peso molecular: 263.92 Número CE: 811-015-4

GRAU & PUREZA ≥98%(GC)

Synonyms

SCHEMBL610877 | A9063 | 2?6-dibromobenzaldehyde | SS-3114 | 2,6-Dibromo Benzaldehyde | 2,6-DIBROMOBENZENECARBALDEHYDE | C7H4Br2O | AM83160 | Benzaldehyde, 2,6-dibromo- | D4552 | Z1269166406 | EN300-115259 | SY020026 | STL556804 | MFCD11040410 | J-507406 |

Storage

Room temperature,Argon charged

Shipped In

Normal

Especificações

Sinónimos

SCHEMBL610877 | A9063 | 2?6-dibromobenzaldehyde | SS-3114 | 2,6-Dibromo Benzaldehyde | 2,6-DIBROMOBENZENECARBALDEHYDE | C7H4Br2O | AM83160 | Benzaldehyde, 2,6-dibromo- | D4552 | Z1269166406 | EN300-115259 | SY020026 | STL556804 | MFCD11040410 | J-507406 |

Especificações e pureza

≥98%(GC)

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%(GC)

Nomes e identificadores

Pubchem Sid

488198205

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488198205

Sorrisos canónicos

C1=CC(=C(C(=C1)Br)C=O)Br

IUPAC Name

2,6-dibromobenzaldehyde

InChIKey

YDYNSAUGVGAOLO-UHFFFAOYSA-N

INCHI

1S/C7H4Br2O/c8-6-2-1-3-7(9)5(6)4-10/h1-4H

SMILES isoméricas

C1=CC(=C(C(=C1)Br)C=O)Br

Peso molecular

263.92

Reaxy-Rn

3236826

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3236826&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoyl derivatives
• Alternative Parents: Benzaldehydes Bromobenzenes Aryl bromides Vinylogous halides Organobromides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzaldehyde - Benzoyl - Aryl-aldehyde - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Vinylogous halide - Organobromide - Organooxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
• 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

Propriedades químicas e físicas

• Sensibilidade: Air Sensitive
• Ponto de fusão (°C): 92 °C
• Peso molecular: 263.910 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 263.861 Da
• Monoisotopic Mass: 261.863 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 117.000
• 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