1-(1H-Indol-3-Yl)-2-(Tert-Butylamino)Propan-1-One Hydrate Hydrochloride
[CAS# 78907-15-0]

Identification

• Name: 1-(1H-Indol-3-Yl)-2-(Tert-Butylamino)Propan-1-One Hydrate Hydrochloride
• Synonyms: 2-(Tert-Butylamino)-1-(3-Indolyl)-1-Propanone Hydrochloride Hydrate; 3-(Tert-Butylamino)Propionylindole Hydrochloride Hydrate; 1-Propanone, 2-(Tert-Butylamino)-1-(3-Indolyl)-, Monohydrochloride, Monohydrate
• Molecular Formula: C₁₅H₂₃ClN₂O₂
• Molecular Weight: 298.81
• CAS Registry Number: 78907-15-0
• SMILES: [H+].C1=C(C(C(C)NC(C)(C)C)=O)C2=C([NH]1)C=CC=C2.[Cl-].O
• InChI: 1S/C15H20N2O.ClH.H2O/c1-10(17-15(2,3)4)14(18)12-9-16-13-8-6-5-7-11(12)13;;/h5-10,16-17H,1-4H3;1H;1H2
• InChIKey: TZPCCCCYPIGCBQ-UHFFFAOYSA-N

Properties

• Boiling point: 404.6°C at 760 mmHg (Cal.)
• Flash point: 198.5°C (Cal.)