5-fluoro-1-benzofuran-4-carbaldehyde - CAS 199391-70-3
Catalog: |
BB015397 |
Product Name: |
5-fluoro-1-benzofuran-4-carbaldehyde |
CAS: |
199391-70-3 |
Synonyms: |
5-fluoro-4-benzofurancarboxaldehyde; 5-fluoro-1-benzofuran-4-carbaldehyde |
IUPAC Name: | 5-fluoro-1-benzofuran-4-carbaldehyde |
Description: | 5-fluoro-1-benzofuran-4-carbaldehyde (CAS# 199391-70-3) is a useful research chemical. |
Molecular Weight: | 164.135 |
Molecular Formula: | C9H5FO2 |
Canonical SMILES: | C1=CC(=C(C2=C1OC=C2)C=O)F |
InChI: | InChI=1S/C9H5FO2/c10-8-1-2-9-6(3-4-12-9)7(8)5-11/h1-5H |
InChI Key: | KVZVZQXBAPJNPX-UHFFFAOYSA-N |
LogP: | 2.38440 |
Publication Number | Title | Priority Date |
AU-727416-B2 | Benzofurans and benzopyrans as chronobiological agents | 19960514 |
CA-2253802-A1 | Benzofurans and benzopyrans as chronobiological agents | 19960514 |
DE-69723436-T2 | BENZOFURANE AND BENZPYRANE AS A CHRONOBIOLOGICAL AGENT | 19960514 |
EP-0901483-A2 | Benzofurans and benzopyrans as chronobiological agents | 19960514 |
EP-0901483-B1 | Benzofurans and benzopyrans as chronobiological agents | 19960514 |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.02735756 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.02735756 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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