2-(4-Bromophenyl)-6-(4-chlorophenyl)pyridine-4-carboxylic acid - CAS 38935-52-3
Catalog: |
BB023799 |
Product Name: |
2-(4-Bromophenyl)-6-(4-chlorophenyl)pyridine-4-carboxylic acid |
CAS: |
38935-52-3 |
Synonyms: |
2-(4-bromophenyl)-6-(4-chlorophenyl)pyridine-4-carboxylic acid |
IUPAC Name: | 2-(4-bromophenyl)-6-(4-chlorophenyl)pyridine-4-carboxylic acid |
Description: | 2-(4-Bromophenyl)-6-(4-chlorophenyl)pyridine-4-carboxylic acid (CAS# 38935-52-3) is a useful research chemical compound. |
Molecular Weight: | 388.64 |
Molecular Formula: | C18H11BrClNO2 |
Canonical SMILES: | C1=CC(=CC=C1C2=NC(=CC(=C2)C(=O)O)C3=CC=C(C=C3)Br)Cl |
InChI: | InChI=1S/C18H11BrClNO2/c19-14-5-1-11(2-6-14)16-9-13(18(22)23)10-17(21-16)12-3-7-15(20)8-4-12/h1-10H,(H,22,23) |
InChI Key: | APLDOGUHCNVFLZ-UHFFFAOYSA-N |
Boiling Point: | 604.6 ℃ at 760 mmHg |
Density: | 1.53 g/cm3 |
Solubility: | Water : Insoluble |
MDL: | MFCD03094027 |
LogP: | 5.52970 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CA-1182397-A | 2,6-diaryl-pyridinecarboxylic acids | 19810430 |
EP-0064385-A1 | 2,6-Diaryl-pyridinecarboxylic acids and their therapeutic utility | 19810430 |
EP-0064385-B1 | 2,6-diaryl-pyridinecarboxylic acids and their therapeutic utility | 19810430 |
US-4377586-A | Diuretic 2,6-diaryl-4-pyridine carboxylic acids | 19810430 |
US-4474791-A | Diuretic 2,6-diaryl-4-pyridine carboxylic acids | 19810430 |
Complexity: | 406 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 386.96617 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 386.96617 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 50.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5 |
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