3,5-Difluoro-4-hydroxybenezenemethanol - CAS 206198-07-4
Catalog: |
BB055785 |
Product Name: |
3,5-Difluoro-4-hydroxybenezenemethanol |
CAS: |
206198-07-4 |
Synonyms: |
2,6-Difluoro-4-(hydroxymethyl)phenol; 3,5-Difluoro-4-hydroxybenzyl alcohol; Benzenemethanol, 3,5-difluoro-4-hydroxy- |
IUPAC Name: | 2,6-difluoro-4-(hydroxymethyl)phenol |
Description: | 3,5-Difluoro-4-hydroxybenezenemethanol is used to prepare bioluminiscent probes with sulfatase activity that can be used to study human and prokaryotic cells. |
Molecular Weight: | 160.12 |
Molecular Formula: | C7H6F2O2 |
Canonical SMILES: | C1=C(C=C(C(=C1F)O)F)CO |
InChI: | InChI=1S/C7H6F2O2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,10-11H,3H2 |
InChI Key: | GKBXKARGOXJKOD-UHFFFAOYSA-N |
References: | Rush, J., et. al. ChemBioChem, 11, 2096 (2010). |
Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.03358575 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.03358575 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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