| CAS Number | 4963-16-0 |
| Catalog Number | AG01B1GG(AGN-PC-0NKVL5) |
| Chemical Name | 1-(2-Bromoethoxy)-2-methylpropane |
| IUPAC Name | 1-(2-bromoethoxy)-2-methylpropane |
| InChI | InChI=1S/C6H13BrO/c1-6(2)5-8-4-3-7/h6H,3-5H2,1-2H3 |
| InChI Key | WXZQNJCVYHJEIK-UHFFFAOYSA-N |
| MDL Number | MFCD09815089 |
| Molecular Formula | C6H13BrO |
| Molecular Weight | 181.0708 |
| SMILES | CC(COCCBr)C |
| Synonyms | 1-(2-bromoethoxy)-2-methylpropane,
4963-16-0,
2-(2-methylpropoxy)ethyl bromide,
SCHEMBL5001932,
ZINC19414795,
AKOS000164073,
|
| Complexity | 45.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.073g/mol |
| Monoisotopic Mass | 180.015g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number