Boronic acid, B-(2-fluorophenyl)- supplier

Name
2-FLUOROPHENYLBORONIC ACID
EINECS
CAS No. 1193-03-9
Article Data1
CAS DataBase
Density 1.24 g/cm³
Solubility
Melting Point 101-110 °C (lit.)
Formula C₆H₆BFO₂
Boiling Point 267.8 °C at 760 mmHg
Molecular Weight 187.112
Flash Point 115.8 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms (2-Fluorophenyl)boronic acid;
PSA 29.26000
LogP 1.47950

Boronic acid, B-(2-fluorophenyl)- Specification

The Boronic acid, B-(2-fluorophenyl)-, with the CAS registry number of 1193-03-9, is also known as 2-Fluorophenylboronic acid. This chemical's molecular formula is C₆H₆BFO₂ and molecular weight is 139.92. What's more, its systematic name is called (2-Fluorophenyl)boronic acid.

Physical properties about Boronic acid, B-(2-fluorophenyl)- are: (1)ACD/LogP: 1.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.64; (4)ACD/LogD (pH 7.4): 1.59; (5)ACD/BCF (pH 5.5): 10.39; (6)ACD/BCF (pH 7.4): 9.3; (7)ACD/KOC (pH 5.5): 185.8; (8)ACD/KOC (pH 7.4): 166.31; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.508; (14) Molar Refractivity: 33.4 cm³; (15)Molar Volume: 111.9 cm³; (16)Surface Tension: 38.6 dyne/cm; (17)Density: 1.24 g/cm³; (18)Flash Point: 115.8 °C; (19)Enthalpy of Vaporization: 53.44 kJ/mol; (20)Boiling Point: 267.8 °C at 760 mmHg; (21)Vapour Pressure: 0.00395 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1ccccc1B(O)O
(2) InChI: InChI=1/C6H6BFO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4,9-10H
(3) InChIKey: QCSLIRFWJPOENV-UHFFFAOYAY

Product Name

2-FLUOROPHENYLBORONIC ACID

Boronic acid, B-(2-fluorophenyl)- Specification

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