3,5-Bis(2-cyanoprop-2-yl)toluene
- CAS NO.：120511-72-0
- Empirical Formula: C15H18N2
- Molecular Weight: 226.32
- MDL number: MFCD08062446
- EINECS: 1806241-263-5
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-05-22 12:34:27
What is 3,5-Bis(2-cyanoprop-2-yl)toluene?
Chemical properties
3,5-Bis(2-cyanoprop-2-yl)toluene is White Solid
The Uses of 3,5-Bis(2-cyanoprop-2-yl)toluene
3,5-Bis(2-cyanoprop-2-yl)toluene is a labelled intermediate in the synthesis of Anastrozole, an aromatase inhibitor. Used as an antineoplastic.
The Uses of 3,5-Bis(2-cyanoprop-2-yl)toluene
An intermediate in the synthesis of Anastrozole (A637425), an aromatase inhibitor. Used as an antineoplastic.
The Uses of 3,5-Bis(2-cyanoprop-2-yl)toluene
α,α,α’,α’-Tetramethyl-5-methyl-1,3-benzenediacetonitrile (Anastrozole EP Impurity H) is an intermediate in the synthesis of Anastrozole (A637425), an aromatase inhibitor. Used as an antineoplastic.
What are the applications of Application
α,α,α′,α′-Tetramethyl-5-methyl-1,3-benzenediacetonitrile is An antineoplastic and an intermediate in the synthesis of Anastrozole
Properties of 3,5-Bis(2-cyanoprop-2-yl)toluene
| Melting point: | 127-130°C |
| Boiling point: | 339.1±32.0 °C(Predicted) |
| Density | 1.002±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Sparingly), Methanol (Slightly) |
| form | Solid |
| color | White to Off-White |
| InChI | InChI=1S/C15H18N2/c1-11-6-12(14(2,3)9-16)8-13(7-11)15(4,5)10-17/h6-8H,1-5H3 |
| CAS DataBase Reference | 120511-72-0(CAS DataBase Reference) |
Safety information for 3,5-Bis(2-cyanoprop-2-yl)toluene
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 3,5-Bis(2-cyanoprop-2-yl)toluene
| InChIKey | SJECEXNMZXMXNE-UHFFFAOYSA-N |
| SMILES | C1(=CC(C)=CC(C(C)(C)C#N)=C1)C(C)(C)C#N |
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