| CAS Number | 1211588-38-3 |
| Catalog Number | AG01A5V9(AGN-PC-0WO8L5) |
| Chemical Name | 2-Chloro-5-(pyridin-3-yl)pyrimidine |
| IUPAC Name | 2-chloro-5-pyridin-3-ylpyrimidine |
| InChI | InChI=1S/C9H6ClN3/c10-9-12-5-8(6-13-9)7-2-1-3-11-4-7/h1-6H |
| InChI Key | BBTYKBWCTGBYSG-UHFFFAOYSA-N |
| MDL Number | MFCD15475287 |
| Molecular Formula | C9H6ClN3 |
| Molecular Weight | 191.6170 |
| SMILES | ClC1=NC=C(C2=CN=CC=C2)C=N1 |
| Synonyms | 2-chloro-5-(pyridin-3-yl)pyrimidine,
1211588-38-3,
2-chloro-5-pyridin-3-yl-pyrimidine,
SCHEMBL444885,
BBTYKBWCTGBYSG-UHFFFAOYSA-N,
ZINC47212647,
AKOS026728860,
Z1924086988,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.618g/mol |
| Monoisotopic Mass | 191.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number