| CAS Number | 875003-50-2 |
| Catalog Number | AG0192XY(AGN-PC-03Q30U) |
| Chemical Name | 5-amino-1-ethyl-2,3-dihydro-1H-indol-2-one |
| IUPAC Name | 5-amino-1-ethyl-3H-indol-2-one |
| InChI | InChI=1S/C10H12N2O/c1-2-12-9-4-3-8(11)5-7(9)6-10(12)13/h3-5H,2,6,11H2,1H3 |
| InChI Key | PYVVLSILSIVNQC-UHFFFAOYSA-N |
| MDL Number | MFCD09907210 |
| Molecular Formula | C10H12N2O |
| Molecular Weight | 176.2151 |
| SMILES | CCN1C2=C(C=C(C=C2)N)CC1=O |
| Synonyms | 5-Amino-1-ethylindolin-2-one,
875003-50-2,
5-amino-1-ethyl-2,3-dihydro-1H-indol-2-one,
5-amino-1-ethyl-1,3-dihydro-2H-indol-2-one,
SCHEMBL4105161,
DTXSID90627604,
PYVVLSILSIVNQC-UHFFFAOYSA-N,
5-amino-1-ethyl-3H-indol-2-one,
ZINC11755822,
AKOS009481307,
MCULE-5513330124,
AJ-60068,
5-amino-1-ethyl-1,3-dihydro-indol-2-one,
VU0421666-2,
L-3142,
F2189-0267,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.219g/mol |
| Monoisotopic Mass | 176.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number