4-Acetoxyphenylboronic Acid Pinacol Ester - CAS 480424-70-2
Catalog: |
BB026461 |
Product Name: |
4-Acetoxyphenylboronic Acid Pinacol Ester |
CAS: |
480424-70-2 |
Synonyms: |
acetic acid [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] ester; [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] acetate |
IUPAC Name: | [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] acetate |
Description: | 4-Acetoxyphenylboronic Acid Pinacol Ester (CAS# 480424-70-2) is a useful research chemical. |
Molecular Weight: | 262.11 |
Molecular Formula: | C14H19O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OC(=O)C |
InChI: | InChI=1S/C14H19BO4/c1-10(16)17-12-8-6-11(7-9-12)15-18-13(2,3)14(4,5)19-15/h6-9H,1-5H3 |
InChI Key: | KHBAJCWEQNVCSN-UHFFFAOYSA-N |
Boiling Point: | 351.9 °C at 760 mmHg |
Melting Point: | 67-71 °C (lit.) |
Flash Point: | Not applicable |
Purity: | 97 % |
Density: | 1.08 g/cm3 |
Appearance: | Solid |
MDL: | MFCD03453060 |
LogP: | 1.91110 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111381458-A | Photoresist cleaning solution | 20181227 |
CN-111381459-A | Photoresist cleaning solution | 20181227 |
TW-201617314-A | Carboxylic acid derivatives | 20140910 |
AU-2010280323-A1 | Novel compounds as modulators of glucocorticoid receptors | 20090731 |
CA-2769563-A1 | Novel compounds as modulators of glucocorticoid receptors | 20090731 |
Complexity: | 329 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.1376392 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.1376392 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 44.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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