| CAS Number | 7043-11-0 |
| Catalog Number | AG01AGUI(AGN-PC-06NO5Z) |
| Chemical Name | 4-Chloro-2-cyclopropyl-6-methylpyrimidine |
| IUPAC Name | 4-chloro-2-cyclopropyl-6-methylpyrimidine |
| InChI | InChI=1S/C8H9ClN2/c1-5-4-7(9)11-8(10-5)6-2-3-6/h4,6H,2-3H2,1H3 |
| InChI Key | RLILYTYYFLBNJR-UHFFFAOYSA-N |
| MDL Number | MFCD12032988 |
| Molecular Formula | C8H9ClN2 |
| Molecular Weight | 168.6235 |
| SMILES | Cc1nc(C2CC2)nc(c1)Cl |
| Synonyms | 4-chloro-2-cyclopropyl-6-methylpyrimidine,
7043-11-0,
4-chloro-2-cyclopropyl-6-methyl-pyrimidine,
AC1Q2OT2,
SCHEMBL5219725,
ZINC37409129,
AKOS009579159,
NE56082,
EN300-72891,
F8888-5647,
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| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.624g/mol |
| Monoisotopic Mass | 168.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
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