Benzene,1,3-dibromo-2-iodo-5-methyl- supplier

Name
3,5-DIBROMO-4-IODOTOLUENE
EINECS
CAS No. 175278-10-1
Article Data8
CAS DataBase
Density 2.346 g/cm³
Solubility
Melting Point 69-72°C
Formula C₇H₅Br₂I
Boiling Point 319.1 °C at 760 mmHg
Molecular Weight 375.829
Flash Point 146.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,3-Dibromo-2-iodo-5-methylbenzene;2,6-Dibromo-4-methyliodobenzene;Benzene, 1,3-dibromo-2-iodo-5-methyl-;
PSA 0.00000
LogP 4.12460

Benzene,1,3-dibromo-2-iodo-5-methyl- Specification

The Benzene,1,3-dibromo-2-iodo-5-methyl-, with the CAS registry number 175278-10-1, has the systematic name of 1,3-dibromo-2-iodo-5-methylbenzene. It belongs to the following product categories: Halogen toluene; Bromine Compounds; Iodine Compounds. And the molecular formula of the chemical is C₇H₅Br₂I.

The characteristics of Benzene,1,3-dibromo-2-iodo-5-methyl- are as followings: (1)ACD/LogP: 5.03; (2)# of Rule of 5 Violations: 1 ; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 0 Å²; (7)Index of Refraction: 1.663; (8)Molar Refractivity: 59.36 cm³; (9)Molar Volume: 160.1 cm³; (10)Polarizability: 23.53×10^-24cm³; (11)Surface Tension: 47.9 dyne/cm; (12)Density: 2.346 g/cm³; (13)Flash Point: 146.8 °C; (14)Enthalpy of Vaporization: 53.84 kJ/mol; (15)Boiling Point: 319.1 °C at 760 mmHg; (16)Vapour Pressure: 0.000646 mmHg at 25°C.

Uses of Benzene,1,3-dibromo-2-iodo-5-methyl-: It can react with phenylmagnesium bromide to produce 5'-Methyl-m-terphenyl. This reaction will need menstruum tetrahydrofuran. The reaction time is 12 hours with heating, and the yield is about 62%.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc1cc(cc(Br)c1I)C
(2)InChI: InChI=1/C7H5Br2I/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,1H3
(3)InChIKey: VLVXYJATBIXIPF-UHFFFAOYAV

Product Name

3,5-DIBROMO-4-IODOTOLUENE

Benzene,1,3-dibromo-2-iodo-5-methyl- Specification

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