8-Chloro-4-oxo-4H-chromene-2-carboxylic Acid - CAS 166538-98-3
Catalog: |
BB012291 |
Product Name: |
8-Chloro-4-oxo-4H-chromene-2-carboxylic Acid |
CAS: |
166538-98-3 |
Synonyms: |
8-chloro-4-oxo-1-benzopyran-2-carboxylic acid; 8-chloro-4-oxochromene-2-carboxylic acid |
IUPAC Name: | 8-chloro-4-oxochromene-2-carboxylic acid |
Description: | 8-Chloro-4-oxo-4H-chromene-2-carboxylic Acid (CAS# 166538-98-3 ) is a useful research chemical. |
Molecular Weight: | 224.60 |
Molecular Formula: | C10H5ClO4 |
Canonical SMILES: | C1=CC2=C(C(=C1)Cl)OC(=CC2=O)C(=O)O |
InChI: | InChI=1S/C10H5ClO4/c11-6-3-1-2-5-7(12)4-8(10(13)14)15-9(5)6/h1-4H,(H,13,14) |
InChI Key: | ISZWNLKXEBIAIJ-UHFFFAOYSA-N |
LogP: | 2.14460 |
Publication Number | Title | Priority Date |
WO-2020223536-A1 | Substituted cyclolakyls as modulators of the integrated stress pathway | 20190430 |
TW-202106671-A | Modulators of the integrated stress pathway | 20190430 |
KR-20200055868-A | 4-oxo-4H-chromene-2-carboxamide derivatives, preparation method thereof, and pharmaceutical composition for use in preventing or treating Urotensin-â…¡ receptor activity related diseases containing the same as an active ingredient | 20181113 |
KR-102166428-B1 | 4-oxo-4H-chromene-2-carboxamide derivatives, preparation method thereof, and pharmaceutical composition for use in preventing or treating Urotensin-â…¡ receptor activity related diseases containing the same as an active ingredient | 20181113 |
WO-2020079106-A1 | Chromen-4-one derivatives for the treatment and prophylaxis of hepatitis b virus disease | 20181019 |
Complexity: | 336 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.9876363 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.9876363 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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