| CAS Number | 1369042-74-9 |
| Catalog Number | AG01B505(AGN-PC-0WNW8G) |
| Chemical Name | 7-Bromo-3,3-dimethylindolin-2-one |
| IUPAC Name | 7-bromo-3,3-dimethyl-1H-indol-2-one |
| InChI | InChI=1S/C10H10BrNO/c1-10(2)6-4-3-5-7(11)8(6)12-9(10)13/h3-5H,1-2H3,(H,12,13) |
| InChI Key | ZRYMHHQESIFOLE-UHFFFAOYSA-N |
| MDL Number | MFCD16657837 |
| Molecular Formula | C10H10BrNO |
| Molecular Weight | 240.0965 |
| SMILES | CC1(C2=CC=CC(Br)=C2NC1=O)C |
| Synonyms | 7-BROMO-3,3-DIMETHYLINDOLIN-2-ONE,
1369042-74-9,
7-bromo-3,3-dimethyl-2,3-dihydro-1H-indol-2-one,
MFCD16657837,
AKOS017550081,
AS-42568,
CS-0055873,
|
| Complexity | 239 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.1g/mol |
| Monoisotopic Mass | 238.995g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number