| CAS Number | 874804-43-0 |
| Catalog Number | AG008CSI(AGN-PC-0WR1PE) |
| Chemical Name | 5,7-Difluoro-4-hydroxyquinoline |
| IUPAC Name | 5,7-difluoro-1H-quinolin-4-one |
| InChI | InChI=1S/C9H5F2NO/c10-5-3-6(11)9-7(4-5)12-2-1-8(9)13/h1-4H,(H,12,13) |
| InChI Key | DGVWPJMXBHHTPO-UHFFFAOYSA-N |
| MDL Number | MFCD06409136 |
| Molecular Formula | C9H5F2NO |
| Molecular Weight | 181.1389 |
| SMILES | OC1=C2C(C=C(C=C2F)F)=NC=C1 |
| Synonyms | 5,7-Difluoro-4-hydroxyquinoline,
874804-43-0,
CTK8E5120,
CTK8F6593,
DTXSID30656135,
5,7-Difluoroquinolin-4(1H)-one,
MFCD06409136,
ZINC35731118,
PC404580,
DB-076975,
FT-0753009,
T6696,
5,7-Difluoro-4-hydroxyquinoline, AldrichCPR,
5,7-Difluoroquinolin-4-ol,
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| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.142g/mol |
| Monoisotopic Mass | 181.034g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number