| CAS Number | 959241-13-5 |
| Catalog Number | AG00H67W(AGN-PC-0WB40U) |
| Chemical Name | 2-Chloro-N-cyclopropylisonicotinamide |
| IUPAC Name | 2-chloro-N-cyclopropylpyridine-4-carboxamide |
| InChI | InChI=1S/C9H9ClN2O/c10-8-5-6(3-4-11-8)9(13)12-7-1-2-7/h3-5,7H,1-2H2,(H,12,13) |
| InChI Key | CEOBTDBKBVPZMI-UHFFFAOYSA-N |
| MDL Number | MFCD09864587 |
| Molecular Formula | C9H9ClN2O |
| Molecular Weight | 196.6336 |
| SMILES | C(=O)(C1C=CN=C(Cl)C=1)NC1CC1 |
| Synonyms | 2-chloro-N-cyclopropylisonicotinamide,
959241-13-5,
2-chloro-N-cyclopropylpyridine-4-carboxamide,
CTK5H8411,
DTXSID40649215,
ALBB-004240,
4497AF,
MFCD09864587,
STK503028,
ZINC19092799,
AKOS000205896,
AJ-71915,
AB0154499,
FT-0678983,
Y-5899,
SR-01000659578,
SR-01000659578-1,
I14-28624,
C9H9ClN2O,
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| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.634g/mol |
| Monoisotopic Mass | 196.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number