4-Bromo-2,6-diethylaniline - ≥98% , CAS No.56746-19-1

CAS: 56746-19-1 Cat. No.: B151819 Formula: C₁₀H₁₄BrN Peso molecolare: 228.13 Beilstein Registry Number: 12(4)2844 Numero EC: 675-682-1

GRADE & PURITY ≥98%

Synonyms

AM62034 | AKOS005172657 | MFCD00059266 | 4-Bromo-2,6-diethylaniline; >98% | B1284 | DTXSID40346353 | 2-[Ethyl[3-[[4-[[1-[2-[(3-fluorophenyl)amino]-2-oxoethyl]-1H-pyrazol-4-yl]amino]quinazolin-7-yl]oxy]propyl]amino]ethyldihydrogenphosphate | AC-27863 | 4-b

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

AM62034 | AKOS005172657 | MFCD00059266 | 4-Bromo-2,6-diethylaniline; >98% | B1284 | DTXSID40346353 | 2-[Ethyl[3-[[4-[[1-[2-[(3-fluorophenyl)amino]-2-oxoethyl]-1H-pyrazol-4-yl]amino]quinazolin-7-yl]oxy]propyl]amino]ethyldihydrogenphosphate | AC-27863 | 4-b

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Protected from light,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

488190725

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488190725

Sorrisi canonici

CCC1=CC(=CC(=C1N)CC)Br

IUPAC Name

4-bromo-2,6-diethylaniline

InChIKey

BEJYDMQQZUACPW-UHFFFAOYSA-N

INCHI

1S/C10H14BrN/c1-3-7-5-9(11)6-8(4-2)10(7)12/h5-6H,3-4,12H2,1-2H3

Isomeri SMILES

CCC1=CC(=CC(=C1N)CC)Br

Peso molecolare

228.13

Beilstein

12(4)2844

Reaxy-Rn

3243385

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3243385&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Bromobenzenes Aryl bromides Primary amines Organopnictogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Halobenzene - Bromobenzene - Aryl halide - Aryl bromide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

Proprietà chimiche e fisiche

• Solubilità: Chloroform (Slightly), Methanol (Slightly)
• Sensibilità: Light Sensitive,Air Sensitive,Heat sensitive
• Indice di rifrazione: 1.58
• Punto di ebollizione (°C): 134°C/3mmHg(lit.)
• Peso molecolare: 228.130 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 227.031 Da
• Monoisotopic Mass: 227.031 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 124.000
• 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