Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

4-Bromo-2-methylbenzonitrile

Related Products

Hot Products

Name

4-Bromo-2-methylbenzonitrile

EINECS N/A
CAS No. 67832-11-5 Density 1.51 g/cm3
PSA 23.79000 LogP 2.62918
Solubility insoluble in water Melting Point 65-69 °C
Formula C8H6BrN Boiling Point 259 °C at 760 mmHg
Molecular Weight 196.046 Flash Point 110.4 °C
Transport Information UN 3439 Appearance white to light yellow crystal powder
Safety 36/37/39-26-22 Risk Codes 22-36/37/38-20/21/22
Molecular Structure Molecular Structure of 67832-11-5 (4-Bromo-2-methylbenzonitrile) Hazard Symbols HarmfulXn, IrritantXi
Synonyms

o-Tolunitrile,4-bromo- (7CI);2-Methyl-4-bromobenzonitrile;NSC229305;

Article Data 3

4-Bromo-2-methylbenzonitrile Specification

The 4-Bromo-2-methylbenzonitrile is an organic compound with the formula C8H6BrN. The IUPAC name of this chemical is 4-bromo-2-methylbenzonitrile. With the CAS registry number 67832-11-5, it is also named as Benzonitrile, 4-bromo-2-methyl-. The product's category is Aromatic Nitriles. Besides, it is a white to light yellow crystal powder, which should be stored in a closed cool and dry palce.

Physical properties about 4-Bromo-2-methylbenzonitrile are: (1)ACD/LogP: 2.88; (2)ACD/LogD (pH 5.5): 2.88; (3)ACD/LogD (pH 7.4): 2.88; (4)ACD/BCF (pH 5.5): 90.43; (5)ACD/BCF (pH 7.4): 90.43; (6)ACD/KOC (pH 5.5): 874.89; (7)ACD/KOC (pH 7.4): 874.89; (8)#H bond acceptors: 1; (9)Polar Surface Area: 23.79 Å2; (10)Index of Refraction: 1.59; (11)Molar Refractivity: 43.66 cm3; (12)Molar Volume: 129.2 cm3; (13)Polarizability: 17.3×10-24cm3; (14)Surface Tension: 49.2 dyne/cm; (15)Density: 1.51 g/cm3; (16)Flash Point: 110.4 °C; (17)Enthalpy of Vaporization: 49.66 kJ/mol; (18)Boiling Point: 259 °C at 760 mmHg; (19)Vapour Pressure: 0.0133 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection and do not breathe dust.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1c(cc(Br)cc1)C
(2)InChI: InChI=1/C8H6BrN/c1-6-4-8(9)3-2-7(6)5-10/h2-4H,1H3
(3)InChIKey: LPEBMDFRIKYFCF-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C8H6BrN/c1-6-4-8(9)3-2-7(6)5-10/h2-4H,1H3
(5)Std. InChIKey: LPEBMDFRIKYFCF-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 67832-11-5