(E)-4-(2-Carboxyvinyl)phenylboronic Acid Pinacol Ester - CAS 1072944-97-8
Catalog: |
BB002028 |
Product Name: |
(E)-4-(2-Carboxyvinyl)phenylboronic Acid Pinacol Ester |
CAS: |
1072944-97-8 |
Synonyms: |
(E)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-2-propenoic acid; (E)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]prop-2-enoic acid |
IUPAC Name: | (E)-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]prop-2-enoic acid |
Description: | (E)-4-(2-Carboxyvinyl)phenylboronic Acid Pinacol Ester (CAS# 1072944-97-8) is a useful research chemical. |
Molecular Weight: | 274.12 |
Molecular Formula: | C15H19O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C=CC(=O)O |
InChI: | InChI=1S/C15H19BO4/c1-14(2)15(3,4)20-16(19-14)12-8-5-11(6-9-12)7-10-13(17)18/h5-10H,1-4H3,(H,17,18)/b10-7+ |
InChI Key: | LNNZFLJPNKVNCC-JXMROGBWSA-N |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD11053843 |
LogP: | 2.08360 |
Complexity: | 379 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 274.1376392 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 274.1376392 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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