[4-[Bis(2-Chloroethyl)Amino]Phenyl] Butanoate
[CAS# 83626-90-8]

Identification

• Name: [4-[Bis(2-Chloroethyl)Amino]Phenyl] Butanoate
• Synonyms: Butanoic Acid [4-[Bis(2-Chloroethyl)Amino]Phenyl] Ester; Butyric Acid [4-[Bis(2-Chloroethyl)Amino]Phenyl] Ester; Phenol, P-(Bis(2-Chloroethyl)Amino)-, Butyrate (Ester)
• Molecular Formula: C₁₄H₁₉Cl₂NO₂
• Molecular Weight: 304.22
• CAS Registry Number: 83626-90-8
• SMILES: C1=CC(=CC=C1OC(CCC)=O)N(CCCl)CCCl
• InChI: 1S/C14H19Cl2NO2/c1-2-3-14(18)19-13-6-4-12(5-7-13)17(10-8-15)11-9-16/h4-7H,2-3,8-11H2,1H3
• InChIKey: JKXFNPYXIMKBMP-UHFFFAOYSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 415.452°C at 760 mmHg (Cal.)
• Flash point: 205.058°C (Cal.)