Benzoyl bromide, 2-(bromomethyl)- supplier

Name
O-BROMOMETHYLBENZOYL BROMIDE
EINECS
CAS No. 40819-28-1
Article Data3
CAS DataBase
Density 1.889 g/cm³
Solubility
Melting Point
Formula C₈H₆Br₂O
Boiling Point 323.6 °C at 760 mmHg
Molecular Weight 277.943
Flash Point 121.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols C,Xi
Synonyms o-Toluoyl bromide, a-bromo-(6CI,7CI);2-(Bromomethyl)benzoylbromide;o-(Bromomethyl)benzoylbromide;a-Bromo-o-toluoyl bromide;
PSA 17.07000
LogP 3.11660

Benzoyl bromide, 2-(bromomethyl)- Specification

The Benzoyl bromide, 2-(bromomethyl)- is an organic compound with the formula C₈H₆Br₂O. The systematic name of this chemical is 2-(bromomethyl)benzoyl bromide. With the CAS registry number 40819-28-1, it is also named as O-Bromomethylbenzoyl bromide. The product's categories are Methyl Halides; Phenyls & Phenyl-Het.

Physical properties about Benzoyl bromide, 2-(bromomethyl)- are: (1)ACD/LogP: 3.08; (2)#H bond acceptors: 1; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 17.07 Å²; (5)Index of Refraction: 1.625; (6)Molar Refractivity: 52.02 cm³; (7)Molar Volume: 147.1 cm³; (8)Polarizability: 20.62×10^-24cm³; (9)Surface Tension: 51.2 dyne/cm; (10)Density: 1.889 g/cm³; (11)Flash Point: 121.7 °C; (12)Enthalpy of Vaporization: 56.55 kJ/mol; (13)Boiling Point: 323.6 °C at 760 mmHg; (14)Vapour Pressure: 0.00026 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCc1ccccc1C(Br)=O
(2)InChI: InChI=1/C8H6Br2O/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4H,5H2
(3)InChIKey: BKBQJEGATMJTIY-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C8H6Br2O/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4H,5H2
(5)Std. InChIKey: BKBQJEGATMJTIY-UHFFFAOYSA-N

Product Name

O-BROMOMETHYLBENZOYL BROMIDE

Benzoyl bromide, 2-(bromomethyl)- Specification

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