1,8-Naphthyridin-3-ylboronic acid pinacol ester supplier

Name
1,8-Naphthyridin-3-ylboronic acid pinacol ester
EINECS
CAS No. 1036379-05-1
Density 1.181 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₉BN₂O₃
Boiling Point 437.246 °C at 760 mmHg
Molecular Weight 274.1233
Flash Point 218.239 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2-Hydroxy-1,1,2-trimethyl-propoxy)-(1,8-naphthyridin-3-yl)borinic acid;
PSA
LogP

1,8-Naphthyridin-3-ylboronic acid pinacol ester Specification

The CAS registry number of 1,8-Naphthyridin-3-ylboronic acid pinacol ester is 1036379-05-1. This chemical's molecular formula is C₁₄H₁₉BN₂O₃ and molecular weight is 274.1233. What's more, its systematic name is called (2-Hydroxy-1,1,2-trimethyl-propoxy)-(1,8-naphthyridin-3-yl)borinic acid.

Physical properties about 1,8-Naphthyridin-3-ylboronic acid pinacol ester are: (1)ACD/LogP: 1.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.468; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 21.691; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 75.47 Å²; (12)Index of Refraction: 1.569; (13)Molar Refractivity: 75.982 cm³; (14)Molar Volume: 232.086 cm³; (15)Surface Tension: 51.27 dyne/cm; (16)Density: 1.181 g/cm³; (17)Flash Point: 218.239 °C; (18)Enthalpy of Vaporization: 73.131 kJ/mol; (19)Boiling Point: 437.246 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: B(c1cc2cccnc2nc1)(O)OC(C)(C)C(C)(C)O
(2) InChI: InChI=1/C14H19BN2O3/c1-13(2,18)14(3,4)20-15(19)11-8-10-6-5-7-16-12(10)17-9-11/h5-9,18-19H,1-4H3
(3) InChIKey: SSDPZHWEVBYDPS-UHFFFAOYAV

Product Name

1,8-Naphthyridin-3-ylboronic acid pinacol ester

1,8-Naphthyridin-3-ylboronic acid pinacol ester Specification

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