| CAS Number | 948291-66-5 |
| Catalog Number | AG00IIKE |
| Chemical Name | 2-Chloro-6-ethoxy-3-methylquinoline |
| IUPAC Name | 2-chloro-6-ethoxy-3-methylquinoline |
| InChI | InChI=1S/C12H12ClNO/c1-3-15-10-4-5-11-9(7-10)6-8(2)12(13)14-11/h4-7H,3H2,1-2H3 |
| InChI Key | DLRPVFUNQNZOAX-UHFFFAOYSA-N |
| MDL Number | MFCD09787670 |
| Molecular Formula | C12H12ClNO |
| Molecular Weight | 221.6828 |
| SMILES | CCOc1ccc2c(c1)cc(c(n2)Cl)C |
| Synonyms | 2-Chloro-6-ethoxy-3-methylquinoline,
948291-66-5,
SCHEMBL12970093,
CTK8E3951,
DTXSID80588992,
MFCD09787670,
ZINC20271032,
AKOS012534553,
AB51945,
RT-007635,
T6809,
2-Chloro-6-ethoxy-3-methylquinoline, AldrichCPR,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.684g/mol |
| Monoisotopic Mass | 221.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number