2-(4-Methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane

Base Information

• Chemical Name: 2-(4-Methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane
• CAS No.: 849100-03-4
• Molecular Formula: C16H19BN2O2
• Molecular Weight: 282.14
• European Community (EC) Number: 689-587-8
• DSSTox Substance ID: DTXSID90584602
• Wikidata: Q72496530
• Mol file: 849100-03-4.mol

Synonyms:849100-03-4;4-Methylpyridine-2-boronic acid N-phenyldiethanolamine ester;2-(4-Methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane;SCHEMBL9967039;DTXSID90584602;AB29833

Chemical Property of 2-(4-Methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane

Chemical Property:

• Vapor Pressure: 1.72E-09mmHg at 25°C
• Melting Point: 267-271 °C
• Refractive Index: 1.572
• Boiling Point: 483.1 °C at 760 mmHg
• Flash Point: 246 °C
• PSA: 34.59000
• Density: 1.14 g/cm³
• LogP: 1.70360
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 282.1539580
• Heavy Atom Count: 21
• Complexity: 303

Purity/Quality:

98%min ^*data from raw suppliers

4-Methylpyridine-2-boronic acid N-phenyldiethanolamine ester ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, F
• Hazard Codes: Xn,F,Xi
• Statements: 11-41-67
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: B1(OCCN(CCO1)C2=CC=CC=C2)C3=NC=CC(=C3)C