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CAS No.: | 175277-97-1 |
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Name: | 3,5-DICHLORO-2-IODOTOLUENE |
Molecular Structure: | |
Formula: | C7H5Cl2I |
Molecular Weight: | 286.927 |
Synonyms: | 3,5-Dichloro-2-iodotoluene; |
Density: | 1.891 g/cm3 |
Melting Point: | 43-45°C |
Boiling Point: | 285.1 °C at 760 mmHg |
Flash Point: | 126.2 °C |
Appearance: | solid |
Safety: | 23-24/25 |
PSA: | 0.00000 |
LogP: | 3.90640 |
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This chemical is called Benzene, 1,5-dichloro-2-iodo-3-methyl-, and its systematic name is 1,5-dichloro-2-iodo-3-methylbenzene. With the molecular formula of C7H5Cl2I, its molecular weight is 286.93. The CAS registry number of this chemical is 175277-97-1. In addition, this chemical should be sealed in the cool and dry place, away from oxides.
Other characteristics of the Benzene, 1,5-dichloro-2-iodo-3-methyl- can be summarised as followings: (1)ACD/LogP: 5.10; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.1; (4)ACD/LogD (pH 7.4): 5.1; (5)ACD/BCF (pH 5.5): 4435.32; (6)ACD/BCF (pH 7.4): 4435.32; (7)ACD/KOC (pH 5.5): 14192.6; (8)ACD/KOC (pH 7.4): 14192.6; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.627; (13)Molar Refractivity: 53.77 cm3; (14)Molar Volume: 151.6 cm3; (15)Polarizability: 21.31×10-24cm3; (16)Surface Tension: 44.7 dyne/cm; (17)Density: 1.891 g/cm3; (18)Flash Point: 126.2 °C; (19)Enthalpy of Vaporization: 50.31 kJ/mol; (20)Boiling Point: 285.1 °C at 760 mmHg; (21)Vapour Pressure: 0.00492 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: Do not breathe vapour. Avoid contacting with skin and eyes.
You can still convert the following datas into molecular structure:
1.SMILES: Ic1c(cc(Cl)cc1Cl)C
2.InChI: InChI=1/C7H5Cl2I/c1-4-2-5(8)3-6(9)7(4)10/h2-3H,1H3
3.InChIKey: MNSJEXGGZOEAPS-UHFFFAOYAS