3-Allyl-3-[2-(Diethylamino)Ethyl]-1H-1,5-Benzodiazepine-2,4(3H,5H)-Dione
[CAS# 54871-42-0]

Identification

• Name: 3-Allyl-3-[2-(Diethylamino)Ethyl]-1H-1,5-Benzodiazepine-2,4(3H,5H)-Dione
• Synonyms: 3-Allyl-3-(2-Diethylaminoethyl)-1,5-Dihydro-1,5-Benzodiazepine-2,4-Dione; 3-Allyl-3-(2-Diethylaminoethyl)-1,5-Dihydro-1,5-Benzodiazepine-2,4-Quinone; 1H-1,5-Benzodiazepine-2,4(3H,5H)-Dione, 3-(2-(Diethylamino)Ethyl)-3-(2-Propenyl)-
• Molecular Formula: C₁₈H₂₅N₃O₂
• Molecular Weight: 315.41
• CAS Registry Number: 54871-42-0
• SMILES: C2=C1NC(=O)C(C(=O)NC1=CC=C2)(CCN(CC)CC)CC=C
• InChI: 1S/C18H25N3O2/c1-4-11-18(12-13-21(5-2)6-3)16(22)19-14-9-7-8-10-15(14)20-17(18)23/h4,7-10H,1,5-6,11-13H2,2-3H3,(H,19,22)(H,20,23)
• InChIKey: PWPWHILEHOYGNT-UHFFFAOYSA-N

Properties

• Density: 1.06g/cm³ (Cal.)
• Boiling point: 499.72°C at 760 mmHg (Cal.)
• Flash point: 256.022°C (Cal.)