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CAS No.: | 199982-02-0 |
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Name: | 4-Butyl-4'-iodobiphenyl |
Molecular Structure: | |
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Formula: | C16H17I |
Molecular Weight: | 336.21 |
Synonyms: | 4-BUTYL-4'-IODOBIPHENYL |
Density: | 1.381 g/cm3 |
Melting Point: | 118.0 to 122.0 °C |
Boiling Point: | 357.137 °C at 760 mmHg |
Flash Point: | 162.02 °C |
PSA: | 0.00000 |
LogP: | 5.30080 |
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The 4-Butyl-4'-iodobiphenyl, its cas register number is 199982-02-0. The Systematic name about this chemicals is 1-tert-Butyl-4-(4-iodophenyl)benzene. If you want to store this chemical, please keep containers tightly sealed, and store in cool, dry place in tightly closed containers, also ensure good ventilation/exhaustion at the workplace. There are some first aid measures: (1)Inhalation: supply fresh air, if required, provide artificial respiration and keep patient warm. (2)Skin contact: seek immediate medical advice and instantly wash with water, soap and rinse thoroughly.
Following are the chemical properties about 4-Butyl-4'-iodobiphenyl: (1)#Freely Rotating Bonds: 2; (2)Index of Refraction: 1.59; (3)Molar Refractivity: 82.139 cm3; (4)Molar Volume: 243.479 cm3; (5)Polarizability: 32.56x10-24cm3; (6)Surface Tension: 37.941 dyne/cm; (7)Enthalpy of Vaporization: 57.873 kJ/mol
This chemical can be described computed from structure:
(1)SMILES: CC(C)(C)c1ccc(cc1)c2ccc(cc2)I
(2)InChI: InChI=1/C16H17I/c1-16(2,3)14-8-4-12(5-9-14)13-6-10-15(17)11-7-13/h4-11H,1-3H3
(3)InChIKey: HPIHETXXQCHXAU-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C16H17I/c1-16(2,3)14-8-4-12(5-9-14)13-6-10-15(17)11-7-13/h4-11H,1-3H3
(5)Std. InChIKey: HPIHETXXQCHXAU-UHFFFAOYSA-N