3-Bis(2-Chloroethyl)Amino-4-Methylphenyl(1-Piperidinyl) Ketone
[CAS# 21447-87-0]

Identification

• Name: 3-Bis(2-Chloroethyl)Amino-4-Methylphenyl(1-Piperidinyl) Ketone
• Synonyms: [3-[Bis(2-Chloroethyl)Amino]-4-Methyl-Phenyl]-(1-Piperidyl)Methanone; [3-[Bis(2-Chloroethyl)Amino]-4-Methylphenyl]-(1-Piperidyl)Methanone; [3-[Bis(2-Chloroethyl)Amino]-4-Methyl-Phenyl]-Piperidino-Methanone
• Molecular Formula: C₁₇H₂₄Cl₂N₂O
• Molecular Weight: 343.30
• CAS Registry Number: 21447-87-0
• SMILES: C2=C(C(N1CCCCC1)=O)C=CC(=C2N(CCCl)CCCl)C
• InChI: 1S/C17H24Cl2N2O/c1-14-5-6-15(17(22)21-9-3-2-4-10-21)13-16(14)20(11-7-18)12-8-19/h5-6,13H,2-4,7-12H2,1H3
• InChIKey: RUDUXQPKMFPBKF-UHFFFAOYSA-N

Properties

• Density: 1.206g/cm³ (Cal.)
• Boiling point: 507.136°C at 760 mmHg (Cal.)
• Flash point: 260.507°C (Cal.)