| CAS Number | 99147-12-3 |
| Catalog Number | AG0066AV(AGN-PC-0OP2HP) |
| Chemical Name | (R)-Dimethyl bromosuccinate |
| IUPAC Name | dimethyl (2R)-2-bromobutanedioate |
| InChI | InChI=1S/C6H9BrO4/c1-10-5(8)3-4(7)6(9)11-2/h4H,3H2,1-2H3/t4-/m1/s1 |
| InChI Key | RGYMYJITHXYRMA-SCSAIBSYSA-N |
| MDL Number | MFCD11974034 |
| Molecular Formula | C6H9BrO4 |
| Molecular Weight | 225.0373 |
| SMILES | COC(=O)C[C@@H](Br)C(=O)OC |
| Synonyms | (R)-DIMETHYL BROMOSUCCINATE,
99147-12-3,
Dimethyl (2R)-2-bromobutanedioate,
AK-43703,
CTK5I0246,
DTXSID80651519,
MFCD11974034,
ZINC20068849,
(R)-2-Bromosuccinic acid dimethyl ester,
AJ-75951,
DS-14227,
FT-0667333,
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.968g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.038g/mol |
| Monoisotopic Mass | 223.968g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 52.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number