| CAS Number | 1202645-50-8 |
| Catalog Number | AG008X05(AGN-PC-0WBNGN) |
| Chemical Name | 9-Methoxymethyl Guanine |
| IUPAC Name | 2-amino-9-(methoxymethyl)-1H-purin-6-one |
| InChI | InChI=1S/C7H9N5O2/c1-14-3-12-2-9-4-5(12)10-7(8)11-6(4)13/h2H,3H2,1H3,(H3,8,10,11,13) |
| InChI Key | WVWIFQBDNZCHIY-UHFFFAOYSA-N |
| MDL Number | MFCD29039604 |
| Molecular Formula | C7H9N5O2 |
| Molecular Weight | 195.1787 |
| SMILES | NC1=NC(=C2N=CN(C2=N1)COC)O |
| Synonyms | 1202645-50-8,
9-Methoxymethyl Guanine,
9-Methoxymethylguanine,
Valganciclovir Impurity C,
SCHEMBL2343359,
2-amino-9-(methoxymethyl)purin-6-ol,
6H-Purin-6-one, 2-amino-1,9-dihydro-9-(methoxymethyl)-,
2-Amino-9-(methoxymethyl)-9H-purin-6-ol,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.182g/mol |
| Monoisotopic Mass | 195.076g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 94.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number