| CAS Number | 1260794-21-5 |
| Catalog Number | AG01AHUC(AGN-PC-0WO5Y5) |
| Chemical Name | 5-Chloro-8-quinolinecarboxaldehyde |
| IUPAC Name | 5-chloroquinoline-8-carbaldehyde |
| InChI | InChI=1S/C10H6ClNO/c11-9-4-3-7(6-13)10-8(9)2-1-5-12-10/h1-6H |
| InChI Key | OEPSEQPKHWYRFR-UHFFFAOYSA-N |
| MDL Number | MFCD15526829 |
| Molecular Formula | C10H6ClNO |
| Molecular Weight | 191.6137 |
| SMILES | O=CC1=CC=C(Cl)C2=C1N=CC=C2 |
| Synonyms | 5-CHLOROQUINOLINE-8-CARBALDEHYDE,
1260794-21-5,
8-Quinolinecarboxaldehyde, 5-chloro-,
ZINC68590208,
AKOS017397874,
NE19423,
SC-34770,
AJ-117119,
EN300-75846,
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| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.614g/mol |
| Monoisotopic Mass | 191.014g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number