Thianthrene-1-boronic acid
Product Information
Molecular Formula
C12H9BO2S2
Molecular Weight
260.144
Description
Reactant for:• Pd2+ and Cu2+ catalyzed oxidative cross-couplings• Preparation of biologically and pharmacologically active molecules• Suzuki-Miyaura cross-coupling reactions
Synonyms
thianthren-1-ylboronicacid; Thianthrene-1-boronicacid; 108847-76-3; Thianthren-1-ylboronicacid; 1-Thianthrenylboronicacid; Thianthren-1-boronicacid
IUPAC Name
thianthren-1-ylboronic acid
SMILES
B(C1=C2C(=CC=C1)SC3=CC=CC=C3S2)(O)O
InChI
InChI=1S/C12H9BO2S2/c14-13(15)8-4-3-7-11-12(8)17-10-6-2-1-5-9(10)16-11/h1-7,14-15H
InChI Key
FZEWPLIHPXGNTB-UHFFFAOYSA-N
Boiling Point
472.7°C at 760 mmHg
Melting Point
146-149°C
Flash Point
Not applicable
Purity
95%
Density
1.48 g/cm3
Appearance
off-white solid
Storage
0-6°C
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
260.0137020 g/mol
Monoisotopic Mass
260.0137020 g/mol
Topological Polar Surface Area
91.1Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
277
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 |
|---|---|---|
| WO-2022008732-A1 | Enhancing the activity of antimicrobial preservatives | 2020-07-10 |
| JP-2021100064-A | Thermoelectric conversion materials and thermoelectric conversion elements | 2019-12-23 |
| WO-2021115912-A1 | Formulations comprising a hydrophobically modified polyethyleneimine and one or more enzymes | 2019-12-09 |
| US-2021167321-A1 | Inorganic light emitting diode and inorganic light emitting device including the same | 2019-11-28 |
| WO-2021100654-A1 | Compound, polymerizable composition, polymer, holographic recording medium, optical material and optical component | 2019-11-19 |
| WO-2021074430-A1 | Storage-stable hydrolase containing liquids | 2019-10-18 |
| WO-2021058452-A1 | Mannanase for formulations having ph 5-12 | 2019-09-23 |
| WO-2021058453-A1 | Mannanase for formulations having ph 5-12 | 2019-09-23 |
| WO-2020229480-A1 | Compounds stabilizing hydrolases in liquids | 2019-05-14 |
| EP-3677676-A1 | Compounds stabilizing amylases in liquids | 2019-01-03 |
