| CAS Number | 1020974-19-9 |
| Catalog Number | AG01A2T7 |
| Chemical Name | 5-bromo-1-(2-methoxyethyl)-2,3-dihydro-1H-indole-2,3-dione |
| IUPAC Name | 5-bromo-1-(2-methoxyethyl)indole-2,3-dione |
| InChI | InChI=1S/C11H10BrNO3/c1-16-5-4-13-9-3-2-7(12)6-8(9)10(14)11(13)15/h2-3,6H,4-5H2,1H3 |
| InChI Key | CYLDYVMECLCGPP-UHFFFAOYSA-N |
| MDL Number | MFCD11147953 |
| Molecular Formula | C11H10BrNO3 |
| Molecular Weight | 284.1060 |
| SMILES | COCCN1C2=C(C=C(C=C2)Br)C(=O)C1=O |
| Synonyms | 5-bromo-1-(2-methoxyethyl)-2,3-dihydro-1H-indole-2,3-dione,
1020974-19-9,
ZINC19966844,
AKOS000245215,
NE23356,
|
| Complexity | 308 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.98441g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.11g/mol |
| Monoisotopic Mass | 282.98441g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number