| CAS Number | 870552-47-9 |
| Catalog Number | AG00IEC2(AGN-PC-0WCYV5) |
| Chemical Name | 2H-Indol-2-one, 4-bromo-1,3-dihydro-3,3-dimethyl- |
| IUPAC Name | 4-bromo-3,3-dimethyl-1H-indol-2-one |
| InChI | InChI=1S/C10H10BrNO/c1-10(2)8-6(11)4-3-5-7(8)12-9(10)13/h3-5H,1-2H3,(H,12,13) |
| InChI Key | JOYAZIZUUBNQFV-UHFFFAOYSA-N |
| MDL Number | MFCD18711494 |
| Molecular Formula | C10H10BrNO |
| Molecular Weight | 240.0965 |
| SMILES | CC1(C)c2c(NC1=O)cccc2Br |
| Synonyms | 4-BROMO-3,3-DIMETHYLINDOLIN-2-ONE,
870552-47-9,
4-bromo-3,3-dimethyl-1H-indol-2-one,
SCHEMBL3149249,
MFCD18711494,
ZINC66054812,
FCH1342217,
AS-35792,
SC-88411,
AX8266537,
CS-0061125,
X-2292,
2H-Indol-2-one, 4-bromo-1,3-dihydro-3,3-dimethyl-,
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| 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 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number