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Phenol,2-iodo-4,5-dimethyl-

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Name

Phenol,2-iodo-4,5-dimethyl-

EINECS N/A
CAS No. 106362-66-7 Density 1.74 g/cm3
PSA 20.23000 LogP 2.61360
Solubility N/A Melting Point N/A
Formula C8H9IO Boiling Point 233.8 °C at 760 mmHg
Molecular Weight 248.063 Flash Point 95.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 106362-66-7 (4,5-DIMETHYL-2-IODOPHENOL) Hazard Symbols N/A
Synonyms

2-Iodo-4,5-dimethylphenol;4,5-Dimethyl-2-iodophenol;

Article Data 6

Phenol,2-iodo-4,5-dimethyl- Specification

The Phenol,2-iodo-4,5-dimethyl-, with the CAS registry number 106362-66-7, is also known as 4,5-Dimethyl-2-iodophenol. This chemical's molecular formula is C8H9IO and molecular weight is 248.06. What's more, its systematic name is 2-Iodo-4,5-dimethylphenol.

Physical properties of Phenol,2-iodo-4,5-dimethyl- are: (1)ACD/LogP: 3.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.57; (4)ACD/LogD (pH 7.4): 3.56; (5)ACD/BCF (pH 5.5): 304.2; (6)ACD/BCF (pH 7.4): 295.85; (7)ACD/KOC (pH 5.5): 2084.53; (8)ACD/KOC (pH 7.4): 2027.28; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.629; (14)Molar Refractivity: 50.69 cm3; (15)Molar Volume: 142.4 cm3; (16)Polarizability: 20.09×10-24 cm3; (17)Surface Tension: 47 dyne/cm; (18)Density: 1.74 g/cm3; (19)Flash Point: 95.2 °C; (20)Enthalpy of Vaporization: 48.97 kJ/mol; (21)Boiling Point: 233.8 °C at 760 mmHg; (22)Vapour Pressure: 0.0358 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(I)c(O)cc1C
(2)InChI: InChI=1/C8H9IO/c1-5-3-7(9)8(10)4-6(5)2/h3-4,10H,1-2H3
(3)InChIKey: QMBMPXRWVSHTCN-UHFFFAOYSA-N

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