| CAS Number | 2031258-76-9 |
| Catalog Number | AG01B6OQ |
| Chemical Name | 1-bromo-3,3-difluoro-2,2-dimethylpentane |
| IUPAC Name | 1-bromo-3,3-difluoro-2,2-dimethylpentane |
| InChI | InChI=1S/C7H13BrF2/c1-4-7(9,10)6(2,3)5-8/h4-5H2,1-3H3 |
| InChI Key | GTUXEJRKCHCURJ-UHFFFAOYSA-N |
| MDL Number | MFCD30344955 |
| Molecular Formula | C7H13BrF2 |
| Molecular Weight | 215.0789 |
| SMILES | CCC(C(CBr)(C)C)(F)F |
| Synonyms | 1-bromo-3,3-difluoro-2,2-dimethylpentane,
2031258-76-9,
ZINC521399245,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.082g/mol |
| Monoisotopic Mass | 214.017g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
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Certificate of Analysis
Lot Number