| CAS Number | 1850-98-2 |
| Catalog Number | AG007RMN(AGN-PC-07H7Y2) |
| Chemical Name | 4,6-Dichloro-2-(propan-2-yl)pyrimidine |
| IUPAC Name | 4,6-dichloro-2-propan-2-ylpyrimidine |
| InChI | InChI=1S/C7H8Cl2N2/c1-4(2)7-10-5(8)3-6(9)11-7/h3-4H,1-2H3 |
| InChI Key | GZRKQOQFSXBYTB-UHFFFAOYSA-N |
| MDL Number | MFCD11043813 |
| Molecular Formula | C7H8Cl2N2 |
| Molecular Weight | 191.0578 |
| SMILES | ClC1=NC(=NC(=C1)Cl)C(C)C |
| Synonyms | 4,6-Dichloro-2-(propan-2-yl)pyrimidine,
1850-98-2,
4,6-dichloro-2-isopropylpyrimidine,
Pyrimidine, 4,6-dichloro-2-(1-methylethyl)-,
SCHEMBL1318237,
CTK0A4997,
DTXSID20498369,
GZRKQOQFSXBYTB-UHFFFAOYSA-N,
4,6-dichloro-2-i-propylpyrimidine,
ZINC58048926,
AKOS012923444,
4,6-Dichloro-2-isopropylpyrimidine, AldrichCPR,
F8883-4400,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.055g/mol |
| Monoisotopic Mass | 190.006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number