B-(Tetrahydro-2H-pyran-4-yl)boronic acid supplier

Name
TETRAHYDROPYRAN-4-BORONIC ACID
EINECS
CAS No. 1072952-46-5
Density 1.111 g/cm³
Solubility
Melting Point
Formula C₅H₁₁BO₃
Boiling Point 279.74 °C at 760 mmHg
Molecular Weight 129.95
Flash Point 122.983 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Boronic acid, B-(tetrahydro-2H-pyran-4-yl)-;
PSA 49.69000
LogP -0.36020

B-(Tetrahydro-2H-pyran-4-yl)boronic acid Specification

The B-(Tetrahydro-2H-pyran-4-yl)boronic acid, with the CAS registry number 1072952-46-5, is also known as Boronic acid, B-(tetrahydro-2H-pyran-4-yl)-. It belongs to the product categories of Organoborons; Pyran. This chemical's molecular formula is C₅H₁₁BO₃ and molecular weight is 129.95. What's more, its systematic name is called Tetrahydro-2H-pyran-4-ylboronic acid.

Physical properties about B-(Tetrahydro-2H-pyran-4-yl)boronic acid are: (1)ACD/LogP: -0.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.17; (4)ACD/LogD (pH 7.4): -0.17; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 19.26; (8)ACD/KOC (pH 7.4): 19.23; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 49.69 Å²; (13)Index of Refraction: 1.449; (14)Molar Refractivity: 31.409 cm³; (15)Molar Volume: 116.928 cm³; (16)Polarizability: 12.451×10^-24cm³; (17)Surface Tension: 36.321 dyne/cm; (18)Density: 1.111 g/cm³; (19)Flash Point: 122.983 °C; (20)Enthalpy of Vaporization: 60.177 kJ/mol; (21)Boiling Point: 279.74 °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(C1CCOCC1)(O)O
(2) InChI: InChI=1S/C5H11BO3/c7-6(8)5-1-3-9-4-2-5/h5,7-8H,1-4H2
(3) InChIKey: PJAHYWURJMYDPM-UHFFFAOYSA-N

Product Name

TETRAHYDROPYRAN-4-BORONIC ACID

B-(Tetrahydro-2H-pyran-4-yl)boronic acid Specification

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