2,6-Difluoro-3-nitrophenylboronic Acid - CAS 1150114-28-5
Catalog: |
BB003459 |
Product Name: |
2,6-Difluoro-3-nitrophenylboronic Acid |
CAS: |
1150114-28-5 |
Synonyms: |
(2,6-difluoro-3-nitrophenyl)boronic acid; (2,6-difluoro-3-nitrophenyl)boronic acid |
IUPAC Name: | (2,6-difluoro-3-nitrophenyl)boronic acid |
Description: | 2,6-Difluoro-3-nitrophenylboronic Acid (CAS# 1150114-28-5) is a useful research chemical. |
Molecular Weight: | 202.91 |
Molecular Formula: | C6H4F2NO4B |
Canonical SMILES: | B(C1=C(C=CC(=C1F)[N+](=O)[O-])F)(O)O |
InChI: | InChI=1S/C6H4BF2NO4/c8-3-1-2-4(10(13)14)6(9)5(3)7(11)12/h1-2,11-12H |
InChI Key: | SPEDPBJIXAVPMJ-UHFFFAOYSA-N |
Appearance: | Pale yellow powder |
Storage: | Inert atmosphere, 2-8 ℃ |
MDL: | MFCD12025957 |
LogP: | 0.07600 |
Publication Number | Title | Priority Date |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
WO-2011127933-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.0201441 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.0201441 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 86.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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