9-Phenanthreneboronic Acid
Product Information
Molecular Formula
C14H11O2B
Molecular Weight
222.05
Description
Reactant involved in the synthesis of: Large polycyclic aromatic hydrocarbons (PAHs); Electron rich benzo[g,h,i]perylenes; FLAP protein inhibitors as antiinflammatory agents; Aminoisoquinolinones as PARP-2 selective inhibitorsReactant involved in homocoupling reactions May contain varying amounts of anhydride.
Synonyms
9-phenanthrenylboronic acid; phenanthren-9-ylboronic acid
IUPAC Name
phenanthren-9-ylboronic acid
SMILES
B(C1=CC2=CC=CC=C2C3=CC=CC=C13)(O)O
InChI
InChI=1S/C14H11BO2/c16-15(17)14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,16-17H
InChI Key
JCDAUYWOHOLVMH-UHFFFAOYSA-N
Boiling Point
479.505 °C at 760 mmHg
Melting Point
165-170 °C
Flash Point
Not applicable
Purity
98 %
Density
1.268 g/cm3
Appearance
White to beige powder or crystalline powder
LogP
1.67280
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
222.0852098 g/mol
Monoisotopic Mass
222.0852098 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
269
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114057718-A | Triphenylamine derivative, preparation, organic photoelectric device and display or lighting device | 2022-01-17 |
| CN-113861218-A | Spiro pyrrolocarbazole compound and application thereof | 2021-09-30 |
| CN-114075117-A | Organic compound, and electronic element and electronic device using same | 2021-06-04 |
| CN-113248477-A | Organic compound, organic electroluminescent material and organic electroluminescent element | 2021-05-14 |
| CN-113816898-A | Compound, electron transport material, organic electroluminescent device and display device | 2021-03-29 |
| CN-112961140-A | Naphthoquinone heterocyclic compound and application thereof | 2021-02-08 |
| CN-112920221-A | Chiral phosphoric acid with spiro-bis-dihydrobenzothiole skeleton and preparation method and application thereof | 2021-01-26 |
| CN-112625042-A | Organic electroluminescent material and application thereof | 2020-12-28 |
| CN-112661761-A | Organic photoelectric material containing phenazine imidazole structure and application thereof | 2020-12-23 |
| CN-112645791-A | Novel OLED material and preparation method and application thereof | 2020-12-22 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 4624 | 1976-03-18 | Regulation of cell volume and ion concentrations in a Halobacterium | The Journal of membrane biology |
