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Basic Information
CAS No.: 199982-02-0
Name: 4-Butyl-4'-iodobiphenyl
Molecular Structure:
Molecular Structure of 199982-02-0 (4-Butyl-4'-iodobiphenyl)
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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  • 4-Butyl-4'-iodobiphenylCAS NO.: 199982-02-0

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  • 4-Butyl-4'-iodobiphenylCAS NO.: 199982-02-0

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    199982-02-0

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  • 4-Butyl-4'-iodobiphenyl

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    199982-02-0

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Specification

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