4-Hydroxyphenylboronic Acid Pinacol Ester
Product Information
Molecular Formula
C12H17O3B
Molecular Weight
220.07
Description
Widely used in Suzuki coupling chemistry.
Synonyms
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol; 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
IUPAC Name
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)O
InChI
InChI=1S/C12H17BO3/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8,14H,1-4H3
InChI Key
BICZJRAGTCRORZ-UHFFFAOYSA-N
Boiling Point
333.8 °C at 760 mmHg
Melting Point
113-117 °C (lit.)
Flash Point
Not applicable
Purity
97 %
Density
1.08 g/cm3
LogP
1.69140
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
220.1270746 g/mol
Monoisotopic Mass
220.1270746 g/mol
Topological Polar Surface Area
38.7Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
241
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
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113999166-A | Synthesis method of tinib bulin | 2021-12-17 |
| CN-114044860-A | Viscosity reduction type ether polycarboxylate superplasticizer and preparation method thereof | 2021-12-15 |
| CN-114106261-A | Low-hydration-heat-ester polycarboxylate superplasticizer and preparation method thereof | 2021-12-15 |
| CN-114133493-A | Viscosity-reducing type ester polycarboxylate superplasticizer and preparation method thereof | 2021-12-15 |
| CN-114163464-A | Esterification product, low-hydration-heat-ether polycarboxylate superplasticizer and preparation method thereof | 2021-12-15 |
| CN-113861230-A | Synthetic method of terbinafine intermediate | 2021-11-02 |
| CN-113831285-A | Liquid crystal thermal activity delay fluorescent material and application | 2021-09-10 |
| CN-113209131-A | Organic-inorganic dual-drug hybrid anti-tumor molecule, preparation method and application thereof | 2021-04-25 |
| CN-113214327-A | Functional molecule with anti-tumor activity, preparation method and application thereof | 2021-04-25 |
| CN-113214203-A | Small molecule compound based on EZH2 protein degradation and application thereof | 2020-12-16 |
