2-Bromo-4-hydrazinylbenzonitrile - ≥95% , CAS No.263845-82-5

CAS: 263845-82-5 Cat. No.: B192415 Summenformel: C₇H₆BrN₃ Molekulargewicht: 212.05

GRADE & PURITY ≥95%

Synonyms

HZQRBVOUQZHWJF-UHFFFAOYSA-N | DS-5580 | 2-Bromo-4-hydrazinylbenzonitrile | SY045954 | A877244 | MB06425 | Benzonitrile, 2-bromo-4-hydrazinyl- | FT-0719503 | AKOS016013509 | DTXSID70647582 | SCHEMBL383103 | MFCD08669418 | 2-bromo-4-hydrazinobenzonitrile |

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

HZQRBVOUQZHWJF-UHFFFAOYSA-N | DS-5580 | 2-Bromo-4-hydrazinylbenzonitrile | SY045954 | A877244 | MB06425 | Benzonitrile, 2-bromo-4-hydrazinyl- | FT-0719503 | AKOS016013509 | DTXSID70647582 | SCHEMBL383103 | MFCD08669418 | 2-bromo-4-hydrazinobenzonitrile |

Spezifikationen & Reinheit

≥95%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504769860

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504769860

Kanonisches Lächeln

C1=CC(=C(C=C1NN)Br)C#N

IUPAC Name

2-bromo-4-hydrazinylbenzonitrile

InChIKey

HZQRBVOUQZHWJF-UHFFFAOYSA-N

INCHI

1S/C7H6BrN3/c8-7-3-6(11-10)2-1-5(7)4-9/h1-3,11H,10H2

Isomere SMILES

C1=CC(=C(C=C1NN)Br)C#N

Molekulargewicht

212.05

Reaxy-Rn

8480518

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8480518&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Phenylhydrazines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Phenylhydrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylhydrazines
• Alternative Parents: Benzonitriles Bromobenzenes Aryl bromides Nitriles Organobromides Hydrocarbon derivatives Hydrazines and derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzonitrile - Phenylhydrazine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Nitrile - Carbonitrile - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrazine derivative - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenylhydrazines. These are compounds containing a phenylhydrazide moiety, which consists of a hydrazide substituent attached to a phenyl 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 212.050 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 210.975 Da
• Monoisotopic Mass: 210.975 Da
• Topological Polar Surface Area: 61.800 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 174.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 263845-82-5, the molecular formula is C7H6BrN3, and the molecular weight is 212.05 g/mol. InChIKey HZQRBVOUQZHWJF-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.