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

Name
3-BROMO-4-IODOTOLUENE
EINECS
CAS No. 71838-16-9
Article Data10
CAS DataBase
Density 2.062 g/cm³
Solubility
Melting Point 265-267 °C
Formula C₇H₆BrI
Boiling Point 266.7 °C at 760 mmHg
Molecular Weight 296.933
Flash Point 115.1 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Toluene,3-bromo-4-iodo- (6CI);2-Bromo-1-iodo-4-methylbenzene;3-Bromo-4-iodotoluene;
PSA 0.00000
LogP 3.36210

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

This chemical is called Benzene,2-bromo-1-iodo-4-methyl-, and its systematic name is 2-bromo-1-iodo-4-methylbenzene. With the molecular formula of C₇H₆BrI, its molecular weight is 296.93. The CAS registry number of this chemical is 71838-16-9. Additionally, its product categories are Halogen Toluene; Bromine Compounds; Iodine Compounds.

Other characteristics of the Benzene,2-bromo-1-iodo-4-methyl- can be summarised as followings: (1)ACD/LogP: 4.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.39; (4)ACD/LogD (pH 7.4): 4.39; (5)ACD/BCF (pH 5.5): 1288.37; (6)ACD/BCF (pH 7.4): 1288.37; (7)ACD/KOC (pH 5.5): 5858.23; (8)ACD/KOC (pH 7.4): 5858.23; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 51.67 cm³; (15)Molar Volume: 143.9 cm³; (16)Polarizability: 20.48×10^-24cm³; (17)Surface Tension: 44.1 dyne/cm; (18)Density: 2.062 g/cm³; (19)Flash Point: 115.1 °C; (20)Enthalpy of Vaporization: 48.43 kJ/mol; (21)Boiling Point: 266.7 °C at 760 mmHg; (22)Vapour Pressure: 0.014 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Ic1ccc(cc1Br)C
2.InChI: InChI=1/C7H6BrI/c1-5-2-3-7(9)6(8)4-5/h2-4H,1H3
3.InChIKey: PLAKKSAFIZVHJP-UHFFFAOYAX

Product Name

3-BROMO-4-IODOTOLUENE

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

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