| CAS Number | 190655-14-2 |
| Catalog Number | AG01C0F7(AGN-PC-03IPZ8) |
| Chemical Name | 2,6-Dichloro-9-Ethyl-9H-Purine |
| IUPAC Name | 2,6-dichloro-9-ethylpurine |
| InChI | InChI=1S/C7H6Cl2N4/c1-2-13-3-10-4-5(8)11-7(9)12-6(4)13/h3H,2H2,1H3 |
| InChI Key | PRESUDAFHFFHLT-UHFFFAOYSA-N |
| MDL Number | MFCD11047296 |
| Molecular Formula | C7H6Cl2N4 |
| Molecular Weight | 217.0553 |
| SMILES | CCN1C=NC2=C1N=C(N=C2Cl)Cl |
| Synonyms | 2,6-dichloro-9-ethyl-9H-purine,
190655-14-2,
9H-Purine, 2,6-dichloro-9-ethyl-,
2,6-dichloro-9-ethylpurine,
SCHEMBL183244,
PRESUDAFHFFHLT-UHFFFAOYSA-N,
ZINC96311590,
A1-07145,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.053g/mol |
| Monoisotopic Mass | 215.997g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number