| CAS Number | 731012-08-1 |
| Catalog Number | AG00JDYT(AGN-PC-0WC9B0) |
| Chemical Name | 2-chloro-N-(5-chloropyridin-2-yl)propanamide |
| IUPAC Name | 2-chloro-N-(5-chloropyridin-2-yl)propanamide |
| InChI | InChI=1S/C8H8Cl2N2O/c1-5(9)8(13)12-7-3-2-6(10)4-11-7/h2-5H,1H3,(H,11,12,13) |
| InChI Key | CNAAXGGFJZFRBZ-UHFFFAOYSA-N |
| MDL Number | MFCD04626527 |
| Molecular Formula | C8H8Cl2N2O |
| Molecular Weight | 219.0679 |
| SMILES | CC(C(NC1=NC=C(Cl)C=C1)=O)Cl |
| Synonyms | 2-chloro-N-(5-chloropyridin-2-yl)propanamide,
731012-08-1,
AC1MYDX3,
AC1Q2AXV,
CTK7F4313,
ALBB-018814,
MFCD04626527,
AKOS000122405,
AKOS017258657,
MCULE-8443907001,
NE12960,
EN300-08473,
propanamide, 2-chloro-N-(5-chloro-2-pyridinyl)-,
SR-01000047898,
SR-01000047898-1,
ZINC03887368,
CID3855178,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.065g/mol |
| Monoisotopic Mass | 218.001g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number