| CAS Number | 22319-88-6 |
| Catalog Number | AG00BIN1(AGN-PC-0WD46V) |
| Chemical Name | 8-chloro-6-fluoroquinoline |
| IUPAC Name | 8-chloro-6-fluoroquinoline |
| InChI | InChI=1S/C9H5ClFN/c10-8-5-7(11)4-6-2-1-3-12-9(6)8/h1-5H |
| InChI Key | DDHQDCGPYDWFNY-UHFFFAOYSA-N |
| MDL Number | MFCD13193678 |
| Molecular Formula | C9H5ClFN |
| Molecular Weight | 181.5941 |
| SMILES | c1(cc(c2c(c1)cccn2)Cl)F |
| Synonyms | 8-Chloro-6-fluoroquinoline,
22319-88-6,
Quinoline, 8-chloro-6-fluoro-,
DTXSID70857684,
ZINC95831024,
AKOS022175910,
AJ-135163,
Z2301438515,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.594g/mol |
| Monoisotopic Mass | 181.009g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number