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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 | Hazard Symbols | N/A | |
Synonyms |
2-Iodo-4,5-dimethylphenol;4,5-Dimethyl-2-iodophenol; |
Article Data | 6 |
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