| CAS Number | 1401812-47-2 |
| Catalog Number | AG00HVRR(AGN-PC-0WR85C) |
| Chemical Name | 3-Chloro-2-methoxyquinoline |
| IUPAC Name | 3-chloro-2-methoxyquinoline |
| InChI | InChI=1S/C10H8ClNO/c1-13-10-8(11)6-7-4-2-3-5-9(7)12-10/h2-6H,1H3 |
| InChI Key | ASIHYJGSUSUAAX-UHFFFAOYSA-N |
| MDL Number | MFCD28337394 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.6296 |
| SMILES | COc1nc2ccccc2cc1Cl |
| Synonyms | Quinoline, 3-chloro-2-methoxy-,
1401812-47-2,
SCHEMBL12970296,
ZINC223722014,
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| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.63g/mol |
| Monoisotopic Mass | 193.029g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
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