| CAS Number | 120713-59-9 |
| Catalog Number | AG00HFP1(AGN-PC-02L4GP) |
| Chemical Name | 3-Ethyl-5-hydroxy-1,3-dimethyl-2,3-dihydro-1H-indol-2-one |
| IUPAC Name | 3-ethyl-5-hydroxy-1,3-dimethylindol-2-one |
| InChI | InChI=1S/C12H15NO2/c1-4-12(2)9-7-8(14)5-6-10(9)13(3)11(12)15/h5-7,14H,4H2,1-3H3 |
| InChI Key | HXTZVERNCJVVLU-UHFFFAOYSA-N |
| MDL Number | MFCD24720252 |
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.2530 |
| SMILES | CCC1(C)C(=O)N(C)c2ccc(O)cc12 |
| Synonyms | 120713-59-9,
3-ETHYL-5-HYDROXY-1,3-DIMETHYL-2,3-DIHYDRO-1H-INDOL-2-ONE,
3-Ethyl-5-hydroxy-1,3-dimethylindolin-2-one,
SCHEMBL10382419,
MFCD24720252,
TZ001095,
3-Ethyl-5-hydroxy-1,3-dimethylindol-2-one,
CS-0037035,
2H-Indol-2-one, 3-ethyl-1,3-dihydro-5-hydroxy-1,3-dimethyl-,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.257g/mol |
| Monoisotopic Mass | 205.11g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number