5-[Bis(2-Chloroethyl)Amino]Indole-3-Propionic Acid Methyl Ester
[CAS# 93017-66-4]

Identification

• Name: 5-[Bis(2-Chloroethyl)Amino]Indole-3-Propionic Acid Methyl Ester
• Synonyms: 3-[5-[Bis(2-Chloroethyl)Amino]-1H-Indol-3-Yl]Propanoic Acid Methyl Ester; 3-[5-[Bis(2-Chloroethyl)Amino]-1H-Indol-3-Yl]Propionic Acid Methyl Ester; 1H-Indole-3-Propanoic Acid, 5-[Bis(2-Chloroethyl)Amino]-, Methyl Ester
• Molecular Formula: C₁₆H₂₀Cl₂N₂O₂
• Molecular Weight: 343.25
• CAS Registry Number: 93017-66-4
• SMILES: C1=CC(=CC2=C1[NH]C=C2CCC(=O)OC)N(CCCl)CCCl
• InChI: 1S/C16H20Cl2N2O2/c1-22-16(21)5-2-12-11-19-15-4-3-13(10-14(12)15)20(8-6-17)9-7-18/h3-4,10-11,19H,2,5-9H2,1H3
• InChIKey: UJMUCMMVMLXILD-UHFFFAOYSA-N

Properties

• Density: 1.295g/cm³ (Cal.)
• Boiling point: 503.981°C at 760 mmHg (Cal.)
• Flash point: 258.599°C (Cal.)