CAS 120511-84-4

5-(Bromomethyl)-α1,α1,α3,α3-tetramethyl-1,3-benzenediacetonitrile

Description:

5-(Bromomethyl)-α1,α1,α3,α3-tetramethyl-1,3-benzenediacetonitrile, with the CAS number 120511-84-4, is a chemical compound characterized by its complex structure, which includes a bromomethyl group and multiple methyl substituents on a benzene ring. This compound features two cyano (nitrile) groups, contributing to its reactivity and potential applications in organic synthesis. The presence of bromine enhances its electrophilic character, making it useful in various chemical reactions, including nucleophilic substitutions. The tetramethyl groups provide steric hindrance, influencing the compound's reactivity and solubility in organic solvents. Typically, compounds of this nature are studied for their potential applications in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. Its physical properties, such as melting point, boiling point, and solubility, would depend on the specific conditions and purity of the sample. Safety data should be consulted for handling, as brominated compounds can pose health risks. Overall, this compound exemplifies the intricate interplay of functional groups in organic chemistry.

Formula: C₁₅H₁₇BrN₂

InChI: InChI=1S/C15H17BrN2/c1-14(2,9-17)12-5-11(8-16)6-13(7-12)15(3,4)10-18/h5-7H,8H2,1-4H3

InChI key: InChIKey=IHXHGCDOJLOZML-UHFFFAOYSA-N

SMILES: C(C#N)(C)(C)C1=CC(C(C#N)(C)C)=CC(CBr)=C1

Synonyms:

• 1,3-Benzenediacetonitrile, 5-(bromomethyl)-α,α,α′,α′-tetramethyl-
• 1,3-Benzenediacetonitrile, 5-(bromomethyl)-α¹,α¹,α³,α³-tetramethyl-
• 2,2'-(5-Bromomethyl-1,3-Phenylene Di(2-Methylpropiononitrile)
• 2,2'-(5-Bromomethyl-1,3-phenylene)-di-(2-methylpronitrile)
• 2,2'-[5-(Bromomethyl)Benzene-1,3-Diyl]Bis(2-Methylpropanenitrile)
• 2,2′-(5-(Bromomethyl)-1,3-phenylene)bis(2-methylpropanenitrile)
• 2-[3-(Bromomethyl)-5-(2-cyanopropan-2-yl)phenyl]-2-methylpropanenitrile
• 3,5-Bis(1-cyano-1-methylethyl)Bromomethyl Benzene
• 3,5-Bis(1-cyano-1-methylethyl)benzyl bromide
• 3,5-Bis(2-Cyanoprop-2-Yl)Benzyl Bromide
• 3,5-Bis-(2-methylpropionitrilo)-benzyl bromide
• 5-(Bromomethyl)-A,A,A',A'-Tetramethyl-1,3-Benzenediacetonitrile
• 5-(Bromomethyl)-α¹,α¹,α³,α³-tetramethyl-1,3-benzenediacetonitrile
• 5-(Bromomethyl)-α1,α1,α3,α3-tetramethyl-1,3-benzenediacetonitrile

2,2'-(5-(BroMoMethyl)-1,3-phenylene)bis(2-Methylpropanenitrile)

CAS: 120511-84-4

Formula: C₁₅H₁₇BrN₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 305.2129

Ref: IN-DA019FU5

Anastrozole EP Impurity C

CAS: 120511-84-4

Formula: C₁₅H₁₇BrN₂

Color and Shape: White To Off-White Solid

Molecular weight: 305.22

Ref: 4Z-A-2412

2,2'-(5-(Bromomethyl)-1,3-Phenylene)Bis(2-Methylpropanenitrile)

CAS: 120511-84-4

2,2'-(5-(Bromomethyl)-1,3-Phenylene)Bis(2-Methylpropanenitrile)

Purity: 97%

Molecular weight: 305.21g/mol

Ref: 54-OR1028368

2,2'-[5-(Bromomethyl)benzene-1,3-diyl]bis(2-methylpropanenitrile)

CAS: 120511-84-4

Color and Shape: Neat

Ref: 86-MM1250.02

α,α,α’,α’-Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile

Controlled Product

CAS: 120511-84-4

Impurity Anastrozole EP Impurity C / Anastrozole USP Related Compound D
Applications α,α,α’,α’-Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile (Anastrozole EP Impurity C) is an impurity of Anastrozole (A637425) (impurity D).
References Ge, Z., et al.: J. Med. Chem., 13, 146 (2003),

Formula: C₁₅H₁₇BrN₂

Color and Shape: Neat

Molecular weight: 305.21

Ref: TR-T291490

2-[3-(Bromomethyl)-5-(1-cyano-1-methylethyl)phenyl]-2-methylpropanenitrile

CAS: 120511-84-4

Formula: C₁₅H₁₇BrN₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 305.219

Ref: 10-F067815

a,a,a',a'-Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile

CAS: 120511-84-4

Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile (TMBDAC) is an impurity standard and a metabolite of the drug product. It is an analytical standard for HPLC. Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile is a high purity research and development chemical that can be custom synthesized to meet specific needs. This synthetic compound has shown potential as a niche metabolite in metabolism studies. CAS No. 120511-84-4.

Formula: C₁₅H₁₇BrN₂

Purity: Min. 95%

Molecular weight: 305.21 g/mol

Ref: 3D-IT28173

Anastrozole EP Impurity C

CAS: 120511-84-4

Formula: C₁₅H₁₇BrN₂

Molecular weight: 305.21

Ref: ST-EA-CP-A60003