| CAS Number | 95970-20-0 |
| Catalog Number | AG01F07C(AGN-PC-00MAPO) |
| Chemical Name | 1,2-dibromo-3-methoxy-5-nitrobenzene |
| IUPAC Name | 1,2-dibromo-3-methoxy-5-nitrobenzene |
| InChI | InChI=1S/C7H5Br2NO3/c1-13-6-3-4(10(11)12)2-5(8)7(6)9/h2-3H,1H3 |
| InChI Key | DWYMLLKXKWHAIC-UHFFFAOYSA-N |
| MDL Number | MFCD11846080 |
| Molecular Formula | C7H5Br2NO3 |
| Molecular Weight | 310.9275 |
| SMILES | BrC1=C(C=C(C=C1Br)[N+](=O)[O-])OC |
| Synonyms | 2,3-Dibromo-5-nitroanisole,
95970-20-0,
SCHEMBL10325884,
DTXSID30539378,
ZINC36532924,
AKOS026672357,
1,2-Dibromo-3-methoxy-5-nitrobenzene,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 310.862g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.929g/mol |
| Monoisotopic Mass | 308.864g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number