| CAS Number | 250263-39-9 |
| Catalog Number | AG00I4S2(AGN-PC-01X61Z) |
| Chemical Name | 4-Pyridinecarboxamide, 2-chloro-N-methoxy-N-methyl- |
| IUPAC Name | 2-chloro-N-methoxy-N-methylpyridine-4-carboxamide |
| InChI | InChI=1S/C8H9ClN2O2/c1-11(13-2)8(12)6-3-4-10-7(9)5-6/h3-5H,1-2H3 |
| InChI Key | RJWKHBDGHZXZPD-UHFFFAOYSA-N |
| MDL Number | MFCD12818828 |
| Molecular Formula | C8H9ClN2O2 |
| Molecular Weight | 200.6223 |
| SMILES | CN(C(=O)C1=CC(=NC=C1)Cl)OC |
| Synonyms | 2-Chloro-N-methoxy-N-methylisonicotinamide,
250263-39-9,
SCHEMBL305997,
RJWKHBDGHZXZPD-UHFFFAOYSA-N,
ZINC37980480,
AKOS009127900,
AJ-94432,
2-chloro-N-methoxyl-N-methylisonicotinamide,
2-chloro-4-(n-methyl-n-methoxycarbamoyl)pyridine,
2-chloro-N-methoxy-N-methylpyridine-4-carboxamide,
2-CHLORO-N-METHOXY-N-METHYL-ISONICOTINAMIDE,
4-Pyridinecarboxamide, 2-chloro-N-methoxy-N-methyl-,
F1903-0258,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.622g/mol |
| Monoisotopic Mass | 200.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number