N-Boc-4-amino-3-fluorophenylboronic Acid Pinacol Ester - CAS 262444-42-8
Catalog: |
BB019215 |
Product Name: |
N-Boc-4-amino-3-fluorophenylboronic Acid Pinacol Ester |
CAS: |
262444-42-8 |
Synonyms: |
N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamic acid tert-butyl ester; tert-butyl N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate |
IUPAC Name: | tert-butyl N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate |
Description: | N-Boc-4-amino-3-fluorophenylboronic Acid Pinacol Ester (CAS# 262444-42-8) is a useful research chemical. |
Molecular Weight: | 337.19 |
Molecular Formula: | C17H25FNO4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)NC(=O)OC(C)(C)C)F |
InChI: | InChI=1S/C17H25BFNO4/c1-15(2,3)22-14(21)20-13-9-8-11(10-12(13)19)18-23-16(4,5)17(6,7)24-18/h8-10H,1-7H3,(H,20,21) |
InChI Key: | KETIHPKFQXFMTA-UHFFFAOYSA-N |
Boiling Point: | 376.622 °C at 760 mmHg |
Density: | 1.117 g/cm3 |
MDL: | MFCD09033883 |
LogP: | 3.54490 |
Publication Number | Title | Priority Date |
EP-2718293-B1 | Substituted pyridopyrazines as novel syk inhibitors | 20110608 |
US-10052330-B2 | Substituted pyrido[3,4-b]pyrazines as Syk inhibitors | 20110608 |
US-2016324864-A1 | Substituted pyridopyrazines as novel syk inhibitors | 20110608 |
WO-2012167423-A1 | Substituted pyridopyrazines as novel syk inhibitors | 20110608 |
CA-2827172-A1 | Selective fak inhibitors | 20110217 |
Complexity: | 462 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 337.1860666 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 337.1860666 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 56.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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