5-(4-Hydroxyphenyl)thiophene-2-carboxylic Acid - CAS 116016-57-0
Catalog: |
BB003684 |
Product Name: |
5-(4-Hydroxyphenyl)thiophene-2-carboxylic Acid |
CAS: |
116016-57-0 |
Synonyms: |
5-(4-hydroxyphenyl)-2-thiophenecarboxylic acid; 5-(4-hydroxyphenyl)thiophene-2-carboxylic acid |
IUPAC Name: | 5-(4-hydroxyphenyl)thiophene-2-carboxylic acid |
Description: | 5-(4-Hydroxyphenyl)thiophene-2-carboxylic Acid (CAS# 116016-57-0 ) is a useful research chemical. |
Molecular Weight: | 220.24 |
Molecular Formula: | C11H8O3S |
Canonical SMILES: | C1=CC(=CC=C1C2=CC=C(S2)C(=O)O)O |
InChI: | InChI=1S/C11H8O3S/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6,12H,(H,13,14) |
InChI Key: | KUFHZPOQBMGGDB-UHFFFAOYSA-N |
LogP: | 2.81890 |
Publication Number | Title | Priority Date |
CA-2651378-C | Fxr agonists | 20060524 |
EP-1992361-B1 | Remedy or preventive for digestive ulcer | 20060224 |
AU-2007212126-A1 | Compounds and methods for modulating FX-receptors | 20060203 |
US-2008306125-A1 | Compounds and Methods for Modulating Fx-Receptors | 20060203 |
US-7863302-B2 | Compounds and methods for modulating FX-receptors | 20060203 |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.01941529 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.01941529 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 85.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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