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Name |
4-Chloro-2-iodophenol |
EINECS | N/A |
CAS No. | 71643-66-8 | Density | 2.087 g/cm3 |
PSA | 20.23000 | LogP | 2.65020 |
Solubility | N/A | Melting Point |
75.0 to 79.0 °C |
Formula | C6H4ClIO | Boiling Point | 225.1 °C at 760 mmHg |
Molecular Weight | 254.455 | Flash Point | 89.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2-Iodo-4-chlorophenol;4-Chloro-2-iodophenol; |
Article Data | 56 |
The 4-Chloro-2-iodophenol with the CAS number 71643-66-8 is also called Phenol,4-chloro-2-iodo-. Its molecular formula is C6H4ClIO. This chemical belongs to the following product categories: (1)Halides; (2)Phenyls & Phenyl-Het. It is irritant. While using this chemical, you should be very cautious.
The properties of the chemical are: (1)ACD/LogP: 3.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.14; (4)ACD/LogD (pH 7.4): 3.05; (5)ACD/BCF (pH 5.5): 142.56; (6)ACD/BCF (pH 7.4): 117.72; (7)ACD/KOC (pH 5.5): 1210.91; (8)ACD/KOC (pH 7.4): 999.88; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.677; (14)Molar Refractivity: 45.93 cm3; (15)Molar Volume: 121.8 cm3; (16)Polarizability: 18.21×10-24cm3; (17)Surface Tension: 56.2 dyne/cm; (18)Enthalpy of Vaporization: 48.03 kJ/mol; (19)Vapour Pressure: 0.059 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1c(O)ccc(Cl)c1
(2)InChI: InChI=1/C6H4ClIO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
(3)InChIKey: JKPLMQJLGBBFLO-UHFFFAOYAE