| CAS Number | 6585-48-4 |
| Catalog Number | AG019Z9O(AGN-PC-0JOJ07) |
| Chemical Name | 2,4,5-trichloro-6-ethylpyrimidine |
| IUPAC Name | 2,4,5-trichloro-6-ethylpyrimidine |
| InChI | InChI=1S/C6H5Cl3N2/c1-2-3-4(7)5(8)11-6(9)10-3/h2H2,1H3 |
| InChI Key | PAMHFOVFWWAYCK-UHFFFAOYSA-N |
| MDL Number | MFCD22196658 |
| Molecular Formula | C6H5Cl3N2 |
| Molecular Weight | 211.4763 |
| NSC Number | 58573 |
| SMILES | CCC1=C(Cl)C(Cl)=NC(Cl)=N1 |
| Synonyms | 2,4,5-trichloro-6-ethylpyrimidine,
6585-48-4,
NSC-58573,
AKOS026726656,
NE22034,
NCI60_004427,
CID246015,
2,4,5-trichloro-6-ethyl-pyrimidine,
NSC58573,
AC1L6H59,
CHEMBL1965178,
CTK6D2601,
DTXSID20289017,
ZINC1689139,
Pyrimidine,4,5-trichloro-6-ethyl-,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.952g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.47g/mol |
| Monoisotopic Mass | 209.952g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number