| CAS Number | 128828-86-4 |
| Catalog Number | AG01FHFH(AGN-PC-0WOLVT) |
| Chemical Name | 2-Bromo-3-methoxybenzyl bromide |
| IUPAC Name | 2-bromo-1-(bromomethyl)-3-methoxybenzene |
| InChI | InChI=1S/C8H8Br2O/c1-11-7-4-2-3-6(5-9)8(7)10/h2-4H,5H2,1H3 |
| InChI Key | IPTDXRBBORUXGS-UHFFFAOYSA-N |
| MDL Number | MFCD18390184 |
| Molecular Formula | C8H8Br2O |
| Molecular Weight | 279.9565 |
| SMILES | |
| Synonyms | 2-Bromo-3-methoxybenzyl bromide,
128828-86-4,
Benzene, bromo-1-(bromomethyl)-3-methoxy-,
113172-87-5,
ACMC-20mhl7,
SCHEMBL9211153,
2-Bromo-3-(bromomethyl)anisole,
CTK0D0325,
DTXSID10561697,
IPTDXRBBORUXGS-UHFFFAOYSA-N,
MFCD18390184,
ZINC34319695,
AKOS028114928,
PS-10007,
2-Bromo-1-(bromomethyl)-3-methoxybenzene,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.892g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 279.959g/mol |
| Monoisotopic Mass | 277.894g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number