5-(2-Carboxythiophene-4-yl)-3-fluorophenol - CAS 1261936-09-7
Catalog: |
BB070506 |
Product Name: |
5-(2-Carboxythiophene-4-yl)-3-fluorophenol |
CAS: |
1261936-09-7 |
Synonyms: |
4-(3-Fluoro-5-hydroxyphenyl)thiophene-2-carboxylic acid; 5-(2-CARBOXYTHIOPHENE-4-YL)-3-FLUOROPHENOL; 4-(3-Fluoro-5-hydroxyphenyl)-thiophene-2-carboxylic acid; 4-(3-Fluoro-5-hydroxyphenyl)thiophene-2-carboxylicacid |
IUPAC Name: | 4-(3-fluoro-5-hydroxyphenyl)thiophene-2-carboxylic acid |
Description: | 5-(2-Carboxythiophene-4-yl)-3-fluorophenol |
Molecular Weight: | 238.24 |
Molecular Formula: | C11H7FO3S |
Canonical SMILES: | C1=C(C=C(C=C1O)F)C2=CSC(=C2)C(=O)O |
InChI: | InChI=1S/C11H7FO3S/c12-8-1-6(2-9(13)4-8)7-3-10(11(14)15)16-5-7/h1-5,13H,(H,14,15) |
InChI Key: | UUTMQRCQJZKQLM-UHFFFAOYSA-N |
Complexity: | 274 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.00999342 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.00999342 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 85.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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