Boronic acid, B-(8-methyl-5-quinolinyl)- supplier

Name
8-METHYL-5-QUINOLINYLBORONIC ACID
EINECS
CAS No. 1025010-58-5
Density 1.24 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₀BNO₂
Boiling Point 401.9 °C at 760 mmHg
Molecular Weight 187
Flash Point 196.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 8-Methyl-5-quinolinylboronic acid;(8-Methyl-5-quinolyl)boronic acid;(8-Methylquinolin-5-yl)boronic acid;
PSA 53.35000
LogP 0.22300

Boronic acid, B-(8-methyl-5-quinolinyl)- Specification

The Boronic acid, B-(8-methyl-5-quinolinyl)-, with the CAS registry number 1025010-58-5, is also known as 8-Methyl-5-quinolinylboronic acid. This chemical's molecular formula is C₁₀H₁₀BNO₂ and molecular weight is 187. What's more, its systematic name is (8-Methylquinolin-5-yl)boronic acid.

Physical properties of Boronic acid, B-(8-methyl-5-quinolinyl)- are: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.9; (4)ACD/LogD (pH 7.4): 1.59; (5)ACD/BCF (pH 5.5): 16.12; (6)ACD/BCF (pH 7.4): 8.02; (7)ACD/KOC (pH 5.5): 251.58; (8)ACD/KOC (pH 7.4): 125.22; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 31.35 Å²; (13)Index of Refraction: 1.627; (14)Molar Refractivity: 53.26 cm³; (15)Molar Volume: 150.1 cm³; (16)Polarizability: 21.11×10^-24cm³; (17)Surface Tension: 55.8 dyne/cm; (18)Density: 1.24 g/cm³; (19)Flash Point: 196.8 °C; (20)Enthalpy of Vaporization: 68.85 kJ/mol; (21)Boiling Point: 401.9 °C at 760 mmHg; (22)Vapour Pressure: 3.52E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OB(O)c1ccc(c2ncccc12)C
(2)InChI: InChI=1S/C10H10BNO2/c1-7-4-5-9(11(13)14)8-3-2-6-12-10(7)8/h2-6,13-14H,1H3
(3)InChIKey: IFARJKOFXMGAPR-UHFFFAOYSA-N

Product Name

8-METHYL-5-QUINOLINYLBORONIC ACID

Boronic acid, B-(8-methyl-5-quinolinyl)- Specification

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