Thiophene-2-boronic acid pinacol ester

C₁₀H₁₅BO₂SCAS 193978-23-3210.10 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₅BO₂S
Molar mass: 210.10 g/mol
Exact mass: 210.0886 Da
logP: 2.05Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

193978-23-3

SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=CS2

InChIKey

FFZHICFAHSDFKZ-UHFFFAOYSA-N

InChI

InChI=1S/C10H15BO2S/c1-9(2)10(3,4)13-11(12-9)8-6-5-7-14-8/h5-7H,1-4H3

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Names and synonyms

1 names

4,4,5,5-Tetramethyl-2-(thiophen-2-yl)-1,3,2-dioxaborolane

Work with Thiophene-2-boronic acid pinacol ester

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole1086111-09-250 % similar 2-Furanboronic acid pinacol ester374790-93-947 % similar 4,4,5,5-Tetramethyl-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,2-dioxaborolane196212-27-847 % similar 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-2-carbaldehyde1040281-83-145 % similar 2,2'-((1,1'-Biphenyl)-4,4'-diyl)bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane)207611-87-844 % similar 1,3,5-Phenyltriboronic acid, pinacol ester365564-05-243 % similar 2-(4-Biphenylyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane144432-80-443 % similar 4,4,5,5-Tetramethyl-2-o-tolyl-1,3,2-dioxaborolane195062-59-043 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4,4,5,5-Tetramethyl-2-(thiophen-3-yl)-1,3,2-dioxaborolane214360-70-0

Elsewhere

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