| CAS Number | 1258640-88-8 |
| Catalog Number | AG01AANV |
| Chemical Name | 1-(2-azidopropan-2-yl)-2-methoxybenzene |
| IUPAC Name | 1-(2-azidopropan-2-yl)-2-methoxybenzene |
| InChI | InChI=1S/C10H13N3O/c1-10(2,12-13-11)8-6-4-5-7-9(8)14-3/h4-7H,1-3H3 |
| InChI Key | XKEFVSIIMSTLBS-UHFFFAOYSA-N |
| MDL Number | MFCD17480369 |
| Molecular Formula | C10H13N3O |
| Molecular Weight | 191.2297 |
| SMILES | COC1=C(C(N=[N+]=[N-])(C)C)C=CC=C1 |
| Synonyms | 1-(2-azidopropan-2-yl)-2-methoxybenzene,
1258640-88-8,
AC1Q44ZR,
ZINC57218644,
NE38126,
EN300-69118,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.234g/mol |
| Monoisotopic Mass | 191.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 23.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number