| CAS Number | 42204-44-4 |
| Catalog Number | AG007384(AGN-PC-0WNVK6) |
| Chemical Name | 5′-Azido-5′-deoxyguanosine |
| IUPAC Name | 2-amino-9-[5-(azidomethyl)-3,4-dihydroxyoxolan-2-yl]-1H-purin-6-one |
| InChI | InChI=1S/C10H12N8O4/c11-10-15-7-4(8(21)16-10)13-2-18(7)9-6(20)5(19)3(22-9)1-14-17-12/h2-3,5-6,9,19-20H,1H2,(H3,11,15,16,21) |
| InChI Key | IURRXTYHKBREQT-UHFFFAOYSA-N |
| MDL Number | MFCD22124270 |
| Molecular Formula | C10H12N8O4 |
| Molecular Weight | 308.2535 |
| NSC Number | 119855 |
| SMILES | [N-]=[N+]=NC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N)[nH]c2=O |
| Synonyms | 42204-44-4,
AC1MZJXI,
SCHEMBL13833306,
NSC119855,
NSC-119855,
NCGC00096085-01,
2-amino-9-[5-(azidomethyl)-3,4-dihydroxyoxolan-2-yl]-3H-purin-6-one,
2-amino-9-[(2R,3R,4S,5R)-5-(azidomethyl)-3,4-dihydroxyoxolan-2-yl]-3H-purin-6-one,
CID3899327,
2-amino-9-[5-(azidomethyl)-3,4-dihydroxy-oxolan-2-yl]-3H-purin-6-one,
|
| Complexity | 549 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 308.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 308.258g/mol |
| Monoisotopic Mass | 308.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 149A^2 |
| Undefined Atom Stereocenter Count | 4 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number