4-(4-Fluorophenoxy)phenylboronic acid supplier

Name
4-(4-Fluorophenoxy)phenylboronic acid
EINECS
CAS No. 361437-00-5
Article Data3
CAS DataBase
Density 1.303 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₀BFO₃
Boiling Point 373.916 °C at 760 mmHg
Molecular Weight 232.019
Flash Point 179.938 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [4-(4-Fluorophenoxy)phenyl]boronic acid;
PSA 49.69000
LogP 1.29780

4-(4-Fluorophenoxy)phenylboronic acid Specification

The 4-(4-Fluorophenoxy)phenylboronic acid, with the CAS registry number 361437-00-5, is also known as (2-Methyl-4-pyridyl)methylhydrazine. This chemical's molecular formula is C₁₂H₁₀BFO₃ and molecular weight is 232.02. What's more, its IUPAC name and systematic name are the same which is called [4-(4-Fluorophenoxy)phenyl]boronic acid.

Physical properties about 4-(4-Fluorophenoxy)phenylboronic acid: (1)ACD/LogP: 3.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 513; (6)ACD/BCF (pH 7.4): 489; (7)ACD/KOC (pH 5.5): 3029; (8)ACD/KOC (pH 7.4): 2886; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 49.69 Å²; (13) Index of Refraction: 1.587; (14)Molar Refractivity: 59.849 cm³; (15)Molar Volume: 178.066 cm³; (16)Surface Tension: 49.14 dyne/cm; (17)Density: 1.303 g/cm³; (18)Flash Point: 179.938 °C; (19)Enthalpy of Vaporization: 65.538 kJ/mol; (20)Boiling Point: 373.916 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OB(O)c1ccc(cc1)Oc2ccc(F)cc2
(2) InChI: InChI=1/C12H10BFO3/c14-10-3-7-12(8-4-10)17-11-5-1-9(2-6-11)13(15)16/h1-8,15-16H
(3) InChIKey: BXLDWIUCAAJXIZ-UHFFFAOYAI

Product Name

4-(4-Fluorophenoxy)phenylboronic acid

4-(4-Fluorophenoxy)phenylboronic acid Specification

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