| CAS Number | 959432-77-0 |
| Catalog Number | AG01DH9O |
| Chemical Name | 4,6-Dichloro-2-Methyl-2H-Pyrazolo[3,4-d]Pyrimidine |
| IUPAC Name | 4,6-dichloro-2-methylpyrazolo[3,4-d]pyrimidine |
| InChI | InChI=1S/C6H4Cl2N4/c1-12-2-3-4(7)9-6(8)10-5(3)11-12/h2H,1H3 |
| InChI Key | QLHBOALBAOKBJV-UHFFFAOYSA-N |
| MDL Number | MFCD27934984 |
| Molecular Formula | C6H4Cl2N4 |
| Molecular Weight | 203.0288 |
| SMILES | ClC=1C=2C(N=C(N1)Cl)=NN(C2)C |
| Synonyms | 4,6-dichloro-2-methyl-2h-pyrazolo[3,4-d]pyrimidine,
959432-77-0,
SCHEMBL2076650,
AKOS027324418,
ZINC117960732,
SC-91919,
2H-Pyrazolo[3,4-d]pyrimidine, 4,6-dichloro-2-methyl-,
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| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.981g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.026g/mol |
| Monoisotopic Mass | 201.981g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number