9,9-Dihexyl-9H-fluoren-2-boronic acid supplier

Name
9,9-Dihexyl-9H-fluoren-2-boronic acid
EINECS
CAS No. 371193-08-7
Article Data10
CAS DataBase
Density 1.05 g/cm³
Solubility
Melting Point 98°C(lit.)
Formula C₂₅H₃₅BO₂
Boiling Point 542.2 °C at 760 mmHg
Molecular Weight 378.363
Flash Point 281.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Boronic acid, (9,9-dihexyl-9H-fluoren-2-yl)- (9CI);9,9-Di-n-hexylfluoren-2-ylboronic acid;(9,9-Dihexyl-9H-fluoren-2-yl)boronic acid;
PSA 40.46000
LogP 5.57370

9,9-Dihexyl-9H-fluoren-2-boronic acid Specification

The Boronic acid, B-(9,9-dihexyl-9H-fluoren-2-yl)-, with the CAS registry number 371193-08-7, is also known as 9,9-Di-n-hexylfluoren-2-ylboronic acid. This chemical's molecular formula is C₂₅H₃₅BO₂ and molecular weight is 378.36. What's more, its systematic name is (9,9-dihexyl-9H-fluoren-2-yl)boronic acid.

Physical properties of Boronic acid, B-(9,9-dihexyl-9H-fluoren-2-yl)- are: (1)ACD/LogP: 9.88; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 9.88; (4)ACD/LogD (pH 7.4): 9.86; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 5648642; (8)ACD/KOC (pH 7.4): 5339656.5; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 40.46 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 116.14 cm³; (15)Molar Volume: 358.9 cm³; (16)Polarizability: 46.04×10^-24cm³; (17)Surface Tension: 44.6 dyne/cm; (18)Density: 1.05 g/cm³; (19)Flash Point: 281.7 °C; (20)Enthalpy of Vaporization: 86.32 kJ/mol; (21)Boiling Point: 542.2 °C at 760 mmHg; (22)Vapour Pressure: 1.38E-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OB(O)c2ccc3c1ccccc1C(CCCCCC)(CCCCCC)c3c2
(2)Std. InChI: InChI=1S/C25H35BO2/c1-3-5-7-11-17-25(18-12-8-6-4-2)23-14-10-9-13-21(23)22-16-15-20(26(27)28)19-24(22)25/h9-10,13-16,19,27-28H,3-8,11-12,17-18H2,1-2H3
(3)Std. InChIKey: WWASBXIXSWJVJW-UHFFFAOYSA-N

Product Name

9,9-Dihexyl-9H-fluoren-2-boronic acid

9,9-Dihexyl-9H-fluoren-2-boronic acid Specification

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