4-Acetamidophenylboronic Acid Pinacol Ester - CAS 214360-60-8
Catalog: |
BB016858 |
Product Name: |
4-Acetamidophenylboronic Acid Pinacol Ester |
CAS: |
214360-60-8 |
Synonyms: |
N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide; N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide |
IUPAC Name: | N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide |
Description: | 4-Acetamidophenylboronic Acid Pinacol Ester (CAS# 214360-60-8) is a useful research chemical. |
Molecular Weight: | 261.12 |
Molecular Formula: | C14H20NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NC(=O)C |
InChI: | InChI=1S/C14H20BNO3/c1-10(17)16-12-8-6-11(7-9-12)15-18-13(2,3)14(4,5)19-15/h6-9H,1-5H3,(H,16,17) |
InChI Key: | ANGKVUVZQVUVJO-UHFFFAOYSA-N |
Boiling Point: | 423.2 °C at 760 mmHg |
Melting Point: | 160-164 °C (lit.) |
Purity: | 97 % |
Density: | 1.07 g/cm3 |
Appearance: | Solid |
MDL: | MFCD02093722 |
LogP: | 2.01720 |
GHS Hazard Statement: | H315 (97.56%): Causes skin irritation [Warning Skin corrosion/irritation] |
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 |
Publication Number | Title | Priority Date |
WO-2020248864-A1 | Passivator, passivation method therefor and method for preparing semiconductor film | 20190612 |
US-2020206216-A1 | Inhibitors of fibroblast activation protein | 20181221 |
US-2020078364-A1 | Combination therapy with a phosphoinositide 3-kinase inhibitor with a zinc binding moiety | 20180911 |
CN-113164466-A | Combination therapy using phosphoinositide 3-kinase inhibitors having zinc binding moieties | 20180911 |
KR-20210087438-A | Combination therapy with phosphoinositide 3-kinase inhibitors with zinc binding moieties | 20180911 |
Complexity: | 333 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.1536237 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.1536237 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 47.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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