Benzene, 4-bromo-2-iodo-1-methyl- supplier

Name
4-BROMO-2-IODOTOLUENE
EINECS
CAS No. 260558-15-4
Article Data9
CAS DataBase
Density 2.062 g/cm³
Solubility
Melting Point 262-267℃
Formula C₇H₆BrI
Boiling Point 268.4 °C at 760 mmHg
Molecular Weight 296.933
Flash Point 116.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-BROMO-2-IODOTOLUENE;4-Bromo-2-iodo-1-methylbenzene
PSA 0.00000
LogP 3.36210

Benzene, 4-bromo-2-iodo-1-methyl- Specification

This chemical is called Benzene, 4-bromo-2-iodo-1-methyl-, and its systematic name is 4-Bromo-2-iodo-1-methylbenzene. With the molecular formula of C₇H₆BrI, its molecular weight is 296.93. The CAS registry number of this chemical is 260558-15-4. Additionally, its product categories are Bromine Compounds; Iodine Compounds. However, it should be stored at room temperature.

Other characteristics of the chemical can be summarised as followings: (1)ACD/LogP: 4.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.49; (4)ACD/LogD (pH 7.4): 4.49; (5)ACD/BCF (pH 5.5): 1516.08; (6)ACD/BCF (pH 7.4): 1516.08; (7)ACD/KOC (pH 5.5): 6582.01; (8)ACD/KOC (pH 7.4): 6582.01; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.636; (13)Molar Refractivity: 51.67 cm³; (14)Molar Volume: 143.9 cm³; (15)Polarizability: 20.48×10^-24cm³; (16)Surface Tension: 44.1 dyne/cm; (17)Density: 2.062 g/cm³; (18)Flash Point: 116.1 °C; (19)Enthalpy of Vaporization: 48.61 kJ/mol; (20)Boiling Point: 268.4 °C at 760 mmHg; (21)Vapour Pressure: 0.0127 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Cc1ccc(Br)cc1I
2.InChI: InChI=1/C7H6BrI/c1-5-2-3-6(8)4-7(5)9/h2-4H,1H3
3.InChIKey: LRVKMSDCJCZTTB-UHFFFAOYAY

Product Name

4-BROMO-2-IODOTOLUENE

Benzene, 4-bromo-2-iodo-1-methyl- Specification

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