2-Chloro-3,5-dimethylphenylboronic Acid Pinacol Ester - CAS 1256781-74-4
Catalog: |
BB006207 |
Product Name: |
2-Chloro-3,5-dimethylphenylboronic Acid Pinacol Ester |
CAS: |
1256781-74-4 |
Synonyms: |
2-(2-chloro-3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2-chloro-3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(2-chloro-3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 2-Chloro-3,5-dimethylphenylboronic Acid Pinacol Ester (CAS# 1256781-74-4) is a useful research chemical compound. |
Molecular Weight: | 266.57 |
Molecular Formula: | C14H20ClO2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2Cl)C)C |
InChI: | InChI=1S/C14H20BClO2/c1-9-7-10(2)12(16)11(8-9)15-17-13(3,4)14(5,6)18-15/h7-8H,1-6H3 |
InChI Key: | CNXXDGCVMFEQMM-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD17215821 |
LogP: | 3.25600 |
Complexity: | 303 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.1244877 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.1244877 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 18.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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