6-(2-Thienyl)nicotinic Acid - CAS 179408-54-9
Catalog: |
BB013570 |
Product Name: |
6-(2-Thienyl)nicotinic Acid |
CAS: |
179408-54-9 |
Synonyms: |
6-thiophen-2-yl-3-pyridinecarboxylic acid; 6-thiophen-2-ylpyridine-3-carboxylic acid |
IUPAC Name: | 6-thiophen-2-ylpyridine-3-carboxylic acid |
Description: | 6-(2-Thienyl)nicotinic Acid (CAS# 179408-54-9) is a useful research chemical. |
Molecular Weight: | 205.23 |
Molecular Formula: | C10H7NO2S |
Canonical SMILES: | C1=CSC(=C1)C2=NC=C(C=C2)C(=O)O |
InChI: | InChI=1S/C10H7NO2S/c12-10(13)7-3-4-8(11-6-7)9-2-1-5-14-9/h1-6H,(H,12,13) |
InChI Key: | QYGFXNUFKLRCRB-UHFFFAOYSA-N |
Boiling Point: | 389.9 °C at 760 mmHg |
Density: | 1.368 g/cm3 |
LogP: | 2.50830 |
Publication Number | Title | Priority Date |
AU-2005277518-A1 | Histamine H3 receptor agents, preparation and therapeutic uses | 20040823 |
AU-2005277518-B2 | Histamine H3 receptor agents, preparation and therapeutic uses | 20040823 |
CA-2577061-A1 | Histamine h3 receptor agents, preparation and therapeutic uses | 20040823 |
CA-2577061-C | Histamine h3 receptor agents, preparation and therapeutic uses | 20040823 |
EP-1784400-B1 | Histamine h3 receptor agents, preparation and therapeutic uses | 20040823 |
Complexity: | 222 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.01974964 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.01974964 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 78.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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