2-Ethylsulfonylphenylboronic acid supplier

Name
2-Ethylsulfonylphenylboronic acid
EINECS
CAS No. 1042443-60-6
Density 1.341 g/cm³
Solubility
Melting Point
Formula C₈H₁₁BO₄S
Boiling Point 468.424 °C at 760 mmHg
Molecular Weight 214.05
Flash Point 237.095 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-ETHYLSULFONYLPHENYLBORONIC ACID
PSA 82.98000
LogP 0.24080

2-Ethylsulfonylphenylboronic acid Specification

The 2-Ethylsulfonylphenylboronic acid, with the CAS registry number 1042443-60-6, is also known as 2-Ethylsulfonylphenylboronic acid. It belongs to the product category of Boronic Acid. This chemical's molecular formula is C₈H₁₁BO₄S and molecular weight is 214.0465. What's more, its systematic name is (2-Ethylsulfonylphenyl)boronic acid.

Physical properties about 2-Ethylsulfonylphenylboronic acid are: (1)ACD/LogP: 0.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.433; (4)ACD/LogD (pH 7.4): 0.308; (5)ACD/BCF (pH 5.5): 1.254; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 40.887; (8)ACD/KOC (pH 7.4): 30.7; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 82.98 Å²; (13)Index of Refraction: 1.557; (14)Molar Refractivity: 51.363 cm³; (15)Molar Volume: 159.579 cm³; (16)Polarizability: 20.362×10^-24 cm³; (17)Surface Tension: 52.592 dyne/cm; (18)Density: 1.341 g/cm³; (19)Flash Point: 237.095 °C; (20)Enthalpy of Vaporization: 76.971 kJ/mol; (21)Boiling Point: 468.424 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: B(c1ccccc1S(=O)(=O)CC)(O)O
(2) InChI: InChI=1/C8H11BO4S/c1-2-14(12,13)8-6-4-3-5-7(8)9(10)11/h3-6,10-11H,2H2,1H3
(3) InChIKey: GNCPGKLAKBQXAU-UHFFFAOYAC

Product Name

2-Ethylsulfonylphenylboronic acid

2-Ethylsulfonylphenylboronic acid Specification

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