Boronicacid, B-(5-phenoxy-3-pyridinyl)- supplier

Name
5-PHENOXY-3-PYRIDINYL)BORONICACID
EINECS
CAS No. 850991-33-2
Density 1.293 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₀BNO₃
Boiling Point 419.321 °C at 760 mmHg
Molecular Weight 215.016
Flash Point 207.398 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Boronicacid, (5-phenoxy-3-pyridinyl)- (9CI);(5-Phenoxy-3-pyridinyl)boronic acid;
PSA 62.58000
LogP 0.55370

Boronicacid, B-(5-phenoxy-3-pyridinyl)- Specification

The Boronicacid, B-(5-phenoxy-3-pyridinyl)-, with the CAS registry number 850991-33-2, is also known as 5-Phenoxypyridine-3-boronic acid. This chemical's molecular formula is C₁₁H₁₀BNO₃ and molecular weight is 215.015. What's more, its systematic name is called (5-Phenoxy-3-pyridyl)boronic acid.

Physical properties about Boronicacid, B-(5-phenoxy-3-pyridinyl)- are: (1) ACD/LogP: 1.88; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 1.457; (4) Vapour Pressure: 0 mmHg at 25 °C; (5) ACD/BCF (pH 5.5): 5.961; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 94.618; (8) ACD/KOC (pH 7.4): 1.949; (9) #H bond acceptors: 4; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 5; (12) Polar Surface Area: 62.58 Å²; (13)Index of Refraction: 1.608; (14) Molar Refractivity: 57.535 cm³; (15) Molar Volume: 166.295 cm³; (16) Surface Tension: 58.373 dyne/cm; (17) Density: 1.293 g/cm³; (18) Flash Point: 207.398 °C; (19) Enthalpy of Vaporization: 70.953 kJ/mol; (20) Boiling Point: 419.321 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1) SMILES: B(c1cc(cnc1)Oc2ccccc2)(O)O
(2) InChI: InChI=1/C11H10BNO3/c14-12(15)9-6-11(8-13-7-9)16-10-4-2-1-3-5-10/h1-8,14-15H
(3) InChIKey: BXGLMPPRPDSZPL-UHFFFAOYAW

Product Name

5-PHENOXY-3-PYRIDINYL)BORONICACID

Boronicacid, B-(5-phenoxy-3-pyridinyl)- Specification

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