3-Fluoro-5-(furan-2-yl)phenol - CAS 1261996-61-5
Catalog: |
BB056097 |
Product Name: |
3-Fluoro-5-(furan-2-yl)phenol |
CAS: |
1261996-61-5 |
Synonyms: |
3-FLUORO-5-(FURAN-2-YL)PHENOL; 3-Fluoro-5-(2-furyl)phenol |
IUPAC Name: | 3-fluoro-5-(furan-2-yl)phenol |
Description: | 3-Fluoro-5-(furan-2-yl)phenol |
Molecular Weight: | 178.16 |
Molecular Formula: | C10H7FO2 |
Canonical SMILES: | C1=COC(=C1)C2=CC(=CC(=C2)F)O |
InChI: | InChI=1S/C10H7FO2/c11-8-4-7(5-9(12)6-8)10-2-1-3-13-10/h1-6,12H |
InChI Key: | JIDOHQUFVYZIQR-UHFFFAOYSA-N |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.04300762 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.04300762 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 33.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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