| Weight | 187.242 g/mol |
|---|---|
| Formula | C12H13NO |
| Hydrogen Acceptors | 1 |
| Hydrogen Donors | 1 |
| Aromatic Rings | 2 |
| Rotatable Bonds | 3 |
1-(1H-Indol-3-yl)butan-1-one (22582-67-8)
22582-67-8 · 1-(1H-indol-3-yl)-1-butanone
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- Sigma-Aldrich - 1-(1H-Indol-3-yl)butan-1-one128.75 USD
- Fisher Scientific - Search for 1-(1H-Indol-3-yl)butan-1-one
- TCI - Search for 1-(1H-Indol-3-yl)butan-1-one
- (R)-3-amino-1-((3aS,7aS)-octahydro-1H-indol-1-yl)-4-(2,4,5-trifluorophenyl)butan-1-one derivatives as potent inhibitors of dipeptidyl peptidase-4: design, synthesis, biological evaluation, and molecular modeling. (Bioorganic & Medicinal Chemistry, 2014)
- Crystalline forms of 4-((4-((4-fluoro-2-methyl-1H-indol-5-yl)oxy)-6-methoxyquinazolin-7-yl)oxy)-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)butan-1-one and uses thereof (2014)
-
Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 22582-67-8
- 1-(1H-indol-3-yl)-1-butanone
-
SMILESCCCC(=O)C1=CNC2=CC=CC=C21
-
InChIKeyCPSCIKJSJRJTMF-UHFFFAOYSA-N
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Alternate Names
Estimated Properties
| Boiling Point | 337.8 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 338.16 C | EPI Suite |
| Density | 1.14 g/cm3 | EPA T.E.S.T. |
| Flash Point | 178.52 C | EPA T.E.S.T. |
| Melting Point | 105.22 C | EPI Suite |
| Water Solubility | 94 mg/L | EPA T.E.S.T. |
| Water Solubility | 225.95 mg/L | EPI Suite |
External Links
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