Basic information
- Name:
1,3-Benzenediacetonitrile,a1,a1,a3,a3,5-pentamethyl-
- Superlist Name:
- 3,5-Bis(2-cyanoprop-2-yl)toluene
- CAS No.:
120511-72-0
- Molecular Structure:
- Formula:
- C15H18N2
- Molecular Weight:
- 226.32
- Synonyms:
- 1,3-Benzenediacetonitrile,a,a,a',a',5-pentamethyl- (9CI);2,2'-(5-Methyl-1,3-phenylene)di(2-methylpropionitrile);2-[3-(Cyanodimethylmethyl)-5-methylphenyl]-2-methylpropionitrile;3,5-Bis(2-cyano-2-methylethyl)toluene;
- Density:
- 1.002 g/cm3
- Boiling Point:
- 339.089 °C at 760 mmHg
- Flash Point:
- 146.304 °C
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Chemistry
Systematic Name: 2,2'-(5-Methylbenzene-1,3-diyl)bis(2-methylpropanenitrile)
Synonyms of 3,5-Bis(2-cyanoprop-2-yl)toluene (CAS NO.120511-72-0): 2,2'-(5-Methyl-1,3-phenylene)di(2-methylpropionitrile) ; a,a,a',a',5-Pentamethyl-1,3-benzenediacetonitrile
CAS NO: 120511-72-0
Molecular Formula: C15H18N2
Molecular Weight: 226.32
Molecular Structure: 
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 47.58 Å2
Index of Refraction: 1.511
Molar Refractivity: 67.67 cm3
Molar Volume: 225.8 cm3
Surface Tension: 37.1 dyne/cm
Density: 1.002 g/cm3
Flash Point: 146.3 °C
Enthalpy of Vaporization: 58.25 kJ/mol
Boiling Point: 339.1 °C at 760 mmHg
Vapour Pressure: 9.41E-05 mmHg at 25°C
SMILES: N#CC(c1cc(cc(c1)C(C#N)(C)C)C)(C)C
InChI: InChI=1/C15H18N2/c1-11-6-12(14(2,3)9-16)8-13(7-11)15(4,5)10-17/h6-8H,1-5H3
InChIKey: SJECEXNMZXMXNE-UHFFFAOYAQ
Std. 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
Std. InChIKey: SJECEXNMZXMXNE-UHFFFAOYSA-N
Product Categories of 3,5-Bis(2-cyanoprop-2-yl)toluene (CAS NO.120511-72-0): INTERMEDIATESOFANASTROZOLE;Anastrozole;Nitriles;(intermediate of anastrozole);Intermediate of Anastrozole;Anastrazole
