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Basic Information
CAS No.: 81067-45-0
Name: 1-CHLORO-3,5-DIBROMO-2-IODOBENZENE
Molecular Structure:
Molecular Structure of 81067-45-0 (1-CHLORO-3,5-DIBROMO-2-IODOBENZENE)
Formula: C6H2Br2ClI
Molecular Weight: 396.25
Synonyms: 2,4-Dibromo-6-chloroiodobenzene;1,5-Dibromo-3-chloro-2-iodo-benzene;1-Chloro-3,5-dibromo-2-iodobenzene;
Density: 2.542 g/cm3
Boiling Point: 329.2 °C at 760 mmHg
Flash Point: 152.9 °C
PSA: 0.00000
LogP: 4.46960
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Specification

The CAS register number of Benzene,1,5-dibromo-3-chloro-2-iodo- is 81067-45-0. It also can be called as 1-Chloro-3,5-dibromo-2-iodobenzene and the systematic name about this chemical is 1,5-dibromo-3-chloro-2-iodo-benzene. The molecular formula about this chemical is C6H2Br2ClI and molecular weight is 396.25. It belongs to the following product categories, such as Bromine Compounds; Chlorine Compounds; Iodine Compounds and so on.

Physical properties about Benzene,1,5-dibromo-3-chloro-2-iodo- are: (1)ACD/LogP: 5.34; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.34; (4)ACD/LogD (pH 7.4): 5.34; (5)ACD/BCF (pH 5.5): 6776.9; (6)ACD/BCF (pH 7.4): 6776.9; (7)ACD/KOC (pH 5.5): 19223.99; (8)ACD/KOC (pH 7.4): 19223.99; (9)Index of Refraction: 1.688; (10)Molar Refractivity: 59.43 cm3; (11)Molar Volume: 155.8 cm3; (12)Polarizability: 23.56x10-24cm3; (13)Surface Tension: 52.6 dyne/cm; (14)Flash Point: 152.9 °C; (15)Enthalpy of Vaporization: 54.89 kJ/mol; (16)Boiling Point: 329.2 °C at 760 mmHg; (17)Vapour Pressure: 0.000346 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cc(c(c1Cl)I)Br)Br
(2)InChI: InChI=1/C6H2Br2ClI/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
(3)InChIKey: RLXLNRHOXVGHAH-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C6H2Br2ClI/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
(5)Std. InChIKey: RLXLNRHOXVGHAH-UHFFFAOYSA-N