| CAS Number | 172152-57-7 |
| Catalog Number | AG00HZKF(AGN-PC-0WCYYA) |
| Chemical Name | 2-Chloro-4-methoxy-3-methylpyridine |
| IUPAC Name | 2-chloro-4-methoxy-3-methylpyridine |
| InChI | InChI=1S/C7H8ClNO/c1-5-6(10-2)3-4-9-7(5)8/h3-4H,1-2H3 |
| InChI Key | IYJHPMLTPDXMJT-UHFFFAOYSA-N |
| MDL Number | MFCD16610589 |
| Molecular Formula | C7H8ClNO |
| Molecular Weight | 157.5975 |
| SMILES | CC1=C(OC)C=CN=C1Cl |
| Synonyms | 2-chloro-4-methoxy-3-methylpyridine,
172152-57-7,
SCHEMBL4073435,
KS-00000LHT,
MFCD16610589,
ZINC88189786,
AKOS027344606,
FCH1141331,
AK348465,
DS-12694,
Pyridine, 2-chloro-4-methoxy-3-methyl-,
AX8276658,
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| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.597g/mol |
| Monoisotopic Mass | 157.029g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
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