2-(2-Fluorophenyl)-1-benzothiophene - CAS 936734-95-1
Catalog: |
BB064694 |
Product Name: |
2-(2-Fluorophenyl)-1-benzothiophene |
CAS: |
936734-95-1 |
Synonyms: |
2-(2-Fluorophenyl)-1-benzothiophene; 2-(2-Fluorophenyl)benzo[b]thiophene |
IUPAC Name: | 2-(2-fluorophenyl)-1-benzothiophene |
Description: | 2-(2-Fluorophenyl)-1-benzothiophene |
Molecular Weight: | 228.29 |
Molecular Formula: | C14H9FS |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(S2)C3=CC=CC=C3F |
InChI: | InChI=1S/C14H9FS/c15-12-7-3-2-6-11(12)14-9-10-5-1-4-8-13(10)16-14/h1-9H |
InChI Key: | HTGSVDUQRNAKFB-UHFFFAOYSA-N |
Complexity: | 243 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.04089962 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.04089962 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 28.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.7 |
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