4-Hydroxymethyl-2,6-difluorophenylboronic acid - CAS 1451393-60-4
Catalog: |
BB064398 |
Product Name: |
4-Hydroxymethyl-2,6-difluorophenylboronic acid |
CAS: |
1451393-60-4 |
Synonyms: |
4-Hydroxymethyl-2,6-difluorophenylboronic acid; (2,6-Difluoro-4-(hydroxymethyl)phenyl)boronic acid; [2,6-difluoro-4-(hydroxymethyl)phenyl]boronic Acid |
IUPAC Name: | [2,6-difluoro-4-(hydroxymethyl)phenyl]boronic acid |
Description: | 4-Hydroxymethyl-2,6-difluorophenylboronic acid (cas# 1451393-60-4) is a useful research chemical. |
Molecular Weight: | 187.93 |
Molecular Formula: | C7H7BO3F2 |
Canonical SMILES: | B(C1=C(C=C(C=C1F)CO)F)(O)O |
InChI: | InChI=1S/C7H7BF2O3/c9-5-1-4(3-11)2-6(10)7(5)8(12)13/h1-2,11-13H,3H2 |
InChI Key: | MJXZDKYAMFZLML-UHFFFAOYSA-N |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.0456306 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.0456306 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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