7-Chloro-4-hydroxy-2H-chromen-2-one - CAS 18735-81-4
Catalog: |
BB014419 |
Product Name: |
7-Chloro-4-hydroxy-2H-chromen-2-one |
CAS: |
18735-81-4 |
Synonyms: |
7-chloro-4-hydroxy-1-benzopyran-2-one; 7-chloro-4-hydroxychromen-2-one |
IUPAC Name: | 7-chloro-4-hydroxychromen-2-one |
Description: | 7-Chloro-4-hydroxy-2H-chromen-2-one (CAS# 18735-81-4 ) is a useful research chemical. |
Molecular Weight: | 196.59 |
Molecular Formula: | C9H5ClO3 |
Canonical SMILES: | C1=CC2=C(C=C1Cl)OC(=O)C=C2O |
InChI: | InChI=1S/C9H5ClO3/c10-5-1-2-6-7(11)4-9(12)13-8(6)3-5/h1-4,11H |
InChI Key: | PKVBFOLFCIJRRE-UHFFFAOYSA-N |
LogP: | 2.15200 |
Publication Number | Title | Priority Date |
US-2008153872-A1 | Bis-(Coumarin) Compounds With Anti-Inflammatory Activity | 20050114 |
CA-2533584-A1 | Substituted furochromene compounds of antiinflammatory action | 20030725 |
EP-1648901-A1 | Substituted furochromene compounds of antiinflammatory action | 20030725 |
JP-2006528619-A | Substituted furochromene compounds with anti-inflammatory activity | 20030725 |
US-2006148890-A1 | Substituted furochromene compounds of antiinflammatory action | 20030725 |
Complexity: | 262 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.9927217 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.9927217 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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