2,3-Dihydro-5-furylboronic acid pinacol ester
Product Information
Molecular Formula
C10H17BO3
Molecular Weight
196.1
Description
2,3-Dihydro-5-furylboronic acid pinacol ester is an intermediate used in synthetic chemistry for biomedical applications. It plays a significant role in the manufacture of various pharmaceutical drugs, especially those directed towards treating cancer and cardiovascular diseases.
Synonyms
2-(2,3-dihydrofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 1046812-02-5; 2,3-Dihydro-5-furylboronicacidpinacolester; 2-(4,5-Dihydrofuran-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 4,5-Dihydro-5-furylboronicacidpinacolester; SCHEMBL2013150
IUPAC Name
2-(2,3-dihydrofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CCCO2
InChI
InChI=1S/C10H17BO3/c1-9(2)10(3,4)14-11(13-9)8-6-5-7-12-8/h6H,5,7H2,1-4H3
InChI Key
QLKFMGAHJYGUES-UHFFFAOYSA-N
Flash Point
Not applicable
Purity
95%
Density
1.018 g/mL at 25 °C
Appearance
Colorless to tan liquid
Storage
2-8°C
Refractive Index
n20/D 1.467
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
196.1270746 g/mol
Monoisotopic Mass
196.1270746 g/mol
Topological Polar Surface Area
27.7Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
255
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
