| CAS Number | 881687-44-1 |
| Catalog Number | AG01BTFB(AGN-PC-04TKZT) |
| Chemical Name | 4-Chloro-6-(3-chlorophenyl)pyrimidine |
| IUPAC Name | 4-chloro-6-(3-chlorophenyl)pyrimidine |
| InChI | InChI=1S/C10H6Cl2N2/c11-8-3-1-2-7(4-8)9-5-10(12)14-6-13-9/h1-6H |
| InChI Key | WDXFLLJZNGGUTP-UHFFFAOYSA-N |
| MDL Number | MFCD09861685 |
| Molecular Formula | C10H6Cl2N2 |
| Molecular Weight | 225.0740 |
| SMILES | ClC1=CC(C2=NC=NC(Cl)=C2)=CC=C1 |
| Synonyms | 4-Chloro-6-(3-chlorophenyl)pyrimidine,
881687-44-1,
SCHEMBL2228047,
WDXFLLJZNGGUTP-UHFFFAOYSA-N,
ZINC38580330,
AKOS014984138,
F1967-3833,
4-Chloro-6-(3-chloro-phenyl)-pyrimidine,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.072g/mol |
| Monoisotopic Mass | 223.991g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number