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HomeProduct name list3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

  • CAS NO.:120511-84-4
  • Empirical Formula: C15H17BrN2
  • Molecular Weight: 305.21
  • MDL number: MFCD07782114
  • EINECS: 601-717-7
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-05-22 12:34:28
3,5-Bis(2-cyanoprop-2-yl)benzyl bromide Structural

What is 3,5-Bis(2-cyanoprop-2-yl)benzyl bromide?

Chemical properties

Off-White Solid

The Uses of 3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

α,α,α’,α’-Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile (Anastrozole EP Impurity C) is an impurity of Anastrozole(impurity D).

The Uses of 3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

α,α,α’,α’-Tetramethyl-5-bromomethyl-1,3-benzenediacetonitrile (Anastrozole EP Impurity C) is an impurity of Anastrozole (A637425) (impurity D).

Properties of 3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

Melting point: 98-100°C
Boiling point: 380.0±37.0 °C(Predicted)
Density  1.276±0.06 g/cm3(Predicted)
storage temp.  Inert atmosphere,2-8°C
solubility  Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form  Solid
color  White to Off-White
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
CAS DataBase Reference 120511-84-4(CAS DataBase Reference)

Safety information for 3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P270:Do not eat, drink or smoke when using this product.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P312:Call a POISON CENTER or doctor/physician if you feel unwell.
P330:Rinse mouth.
P363:Wash contaminated clothing before reuse.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P403:Store in a well-ventilated place.

Computed Descriptors for 3,5-Bis(2-cyanoprop-2-yl)benzyl bromide

InChIKey IHXHGCDOJLOZML-UHFFFAOYSA-N
SMILES C1(C(C)(C)C#N)=CC(CBr)=CC(C(C)(C)C#N)=C1

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