2,5-Difluoro-4-formylphenylboronic acid - CAS 1228828-19-0
Catalog: |
BB067816 |
Product Name: |
2,5-Difluoro-4-formylphenylboronic acid |
CAS: |
1228828-19-0 |
Synonyms: |
2,5-Difluoro-4-formylphenylphenylboronic acid; (2,5-Difluoro-4-formylphenyl)boronic acid; 2,5-Difluoro-4-formylphenylboronic acid; (2,5-Difluoro-4-formylphenyl)boronicacid |
IUPAC Name: | (2,5-difluoro-4-formylphenyl)boronic acid |
Description: | 2,5-Difluoro-4-formylphenylboronic acid |
Molecular Weight: | 185.92 |
Molecular Formula: | C7H5BF2O3 |
Canonical SMILES: | B(C1=CC(=C(C=C1F)C=O)F)(O)O |
InChI: | InChI=1S/C7H5BF2O3/c9-6-2-5(8(12)13)7(10)1-4(6)3-11/h1-3,12-13H |
InChI Key: | LTCTYEAWYWPJQG-UHFFFAOYSA-N |
Complexity: | 191 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0299805 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0299805 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 57.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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