| CAS Number | 1820686-93-8 |
| Catalog Number | AG00I0VB |
| Chemical Name | 5-Chloro-2-methoxy-3-(2-methoxyethoxy)pyridine |
| IUPAC Name | 5-chloro-2-methoxy-3-(2-methoxyethoxy)pyridine |
| InChI | InChI=1S/C9H12ClNO3/c1-12-3-4-14-8-5-7(10)6-11-9(8)13-2/h5-6H,3-4H2,1-2H3 |
| InChI Key | PQKGYUNBGGBXSD-UHFFFAOYSA-N |
| MDL Number | MFCD28024848 |
| Molecular Formula | C9H12ClNO3 |
| Molecular Weight | 217.6495 |
| SMILES | COCCOc1cc(Cl)cnc1OC |
| Synonyms | 5-Chloro-2-methoxy-3-(2-methoxyethoxy)pyridine,
1820686-93-8,
ZINC169725182,
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| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.649g/mol |
| Monoisotopic Mass | 217.051g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 40.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
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