| CAS Number | 1018286-45-7 |
| Catalog Number | AG01C840 |
| Chemical Name | 1-(6-amino-2,3-dihydro-1H-indol-1-yl)propan-1-one |
| IUPAC Name | 1-(6-amino-2,3-dihydroindol-1-yl)propan-1-one |
| InChI | InChI=1S/C11H14N2O/c1-2-11(14)13-6-5-8-3-4-9(12)7-10(8)13/h3-4,7H,2,5-6,12H2,1H3 |
| InChI Key | SGAIHXQUGMRBEB-UHFFFAOYSA-N |
| MDL Number | MFCD10016469 |
| Molecular Formula | C11H14N2O |
| Molecular Weight | 190.2417 |
| SMILES | CCC(N1C2=C(C=CC(=C2)N)CC1)=O |
| Synonyms | 1-(6-aminoindolin-1-yl)propan-1-one,
1018286-45-7,
1-PROPANONE,1-(6-AMINO-2,3-DIHYDRO-1H-INDOL-1-YL)-,
ZINC19874684,
AKOS000223347,
SC-57320,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.246g/mol |
| Monoisotopic Mass | 190.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number