| CAS Number | 80573-34-8 |
| Catalog Number | AG008MAI(AGN-PC-0WB88I) |
| Chemical Name | 2,3-Dibromo-3-methylbutanoic acid |
| IUPAC Name | 2,3-dibromo-3-methylbutanoic acid |
| InChI | InChI=1S/C5H8Br2O2/c1-5(2,7)3(6)4(8)9/h3H,1-2H3,(H,8,9) |
| InChI Key | RWJNIIYQCXBZFS-UHFFFAOYSA-N |
| MDL Number | MFCD16251535 |
| Molecular Formula | C5H8Br2O2 |
| Molecular Weight | 259.9238 |
| SMILES | CC(C(C(O)=O)Br)(Br)C |
| Synonyms | 2,3-Dibromo-3-methylbutanoic acid,
80573-34-8,
2,3-Dibromo-3-methyl-butyric acid,
AC1LBWQ1,
SCHEMBL11335436,
CTK8D4198,
DTXSID60337627,
RWJNIIYQCXBZFS-UHFFFAOYSA-N,
KS-00001PK5,
MFCD16251535,
2,3-Dibromo-3-methylbutanoic acid #,
AKOS015841142,
MCULE-2600237498,
TC-061463,
alpha,beta-dibromo-beta,beta-dimethylpropionic acid,
CID543735,
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| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.887g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 259.925g/mol |
| Monoisotopic Mass | 257.889g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number