| CAS Number | 71406-62-7 |
| Catalog Number | AG01DWME |
| Chemical Name | 4-chloro-N,N-diethylpyrimidin-2-amine |
| IUPAC Name | 4-chloro-N,N-diethylpyrimidin-2-amine |
| InChI | InChI=1S/C8H12ClN3/c1-3-12(4-2)8-10-6-5-7(9)11-8/h5-6H,3-4H2,1-2H3 |
| InChI Key | MVNADFZYWTVRNK-UHFFFAOYSA-N |
| MDL Number | MFCD14607613 |
| Molecular Formula | C8H12ClN3 |
| Molecular Weight | 185.6540 |
| SMILES | CCN(C1=NC(Cl)=CC=N1)CC |
| Synonyms | 4-chloro-N,N-diethylpyrimidin-2-amine,
71406-62-7,
2-Pyrimidinamine, 4-chloro-N,N-diethyl-,
SCHEMBL11318303,
AKOS010519287,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.655g/mol |
| Monoisotopic Mass | 185.072g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number