| CAS Number | 1199273-60-3 |
| Catalog Number | AG01A4QC |
| Chemical Name | 1-Azido-4-bromo-2-methylbenzene |
| IUPAC Name | 1-azido-4-bromo-2-methylbenzene |
| InChI | InChI=1S/C7H6BrN3/c1-5-4-6(8)2-3-7(5)10-11-9/h2-4H,1H3 |
| InChI Key | UVSZVKGRZLEDLZ-UHFFFAOYSA-N |
| MDL Number | MFCD23701962 |
| Molecular Formula | C7H6BrN3 |
| Molecular Weight | 212.0466 |
| SMILES | [N-]=[N+]=NC1C(C)=CC(Br)=CC=1 |
| Synonyms | 1-azido-4-bromo-2-methylbenzene,
ZINC88125674,
AKOS019859672,
NE17081,
F2157-0590,
1199273-60-3,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.975g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.05g/mol |
| Monoisotopic Mass | 210.975g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 14.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number