4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol supplier

Name
4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol
EINECS
CAS No. 906101-33-5
Article Data3
CAS DataBase
Density 1.007 g/cm³
Solubility
Melting Point
Formula C₁₈H₂₂O
Boiling Point 342.9 °C at 760 mmHg
Molecular Weight 254.372
Flash Point 159.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [1,1'-Biphenyl]-4-ol, 4'-(1,1-dimethylethyl)-2,6-dimethyl-;4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol;LogP
PSA 20.23000
LogP 4.97350

4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol Specification

The 4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol with its cas register number is 906101-33-5. The Systematic name about this chemical is 4-(4-tert-butylphenyl)-3,5-dimethyl-phenol.

Physical properties about 4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol are: (1)ACD/LogP: 5.81; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.81; (4)ACD/LogD (pH 7.4): 5.81; (5)ACD/BCF (pH 5.5): 15290.96; (6)ACD/BCF (pH 7.4): 15266.24; (7)ACD/KOC (pH 5.5): 34419.39; (8)ACD/KOC (pH 7.4): 34363.74; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.23Å²; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 80.76 cm³; (15)Molar Volume: 252.3 cm³; (16)Polarizability: 32.01x10^-24cm³; (17)Surface Tension: 36.1 dyne/cm; (18)Enthalpy of Vaporization: 60.99 kJ/mol; (19)Vapour Pressure: 3.69E-05 mmHg at 25°C

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(cc(c1c2ccc(cc2)C(C)(C)C)C)O
(2)InChI: InChI=1/C18H22O/c1-12-10-16(19)11-13(2)17(12)14-6-8-15(9-7-14)18(3,4)5/h6-11,19H,1-5H3
(3)InChIKey: RIYABMKGORLKGD-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C18H22O/c1-12-10-16(19)11-13(2)17(12)14-6-8-15(9-7-14)18(3,4)5/h6-11,19H,1-5H3
(5)Std. InChIKey: RIYABMKGORLKGD-UHFFFAOYSA-N

Product Name

4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol

4'-tert-Butyl-2,6-dimethylbiphenyl-4-ol Specification

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