2,5-Dibromothiophene-3-boronic Acid Pinacol Ester - CAS 942070-22-6
Catalog: |
BB041222 |
Product Name: |
2,5-Dibromothiophene-3-boronic Acid Pinacol Ester |
CAS: |
942070-22-6 |
Synonyms: |
2-(2,5-dibromo-3-thiophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2,5-dibromothiophen-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(2,5-dibromothiophen-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 2,5-Dibromothiophene-3-boronic Acid Pinacol Ester (CAS# 942070-22-6) is a useful research chemical. |
Molecular Weight: | 367.89 |
Molecular Formula: | C10H13Br2O2SB |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=C(SC(=C2)Br)Br |
InChI: | InChI=1S/C10H13BBr2O2S/c1-9(2)10(3,4)15-11(14-9)6-5-7(12)16-8(6)13/h5H,1-4H3 |
InChI Key: | FBVYFWMGZNOTBO-UHFFFAOYSA-N |
MDL: | MFCD12405469 |
LogP: | 3.57230 |
Complexity: | 272 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 367.90756 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 365.90961 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 46.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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