3-[2-[Bis(2-Chloroethyl)Amino]Phenoxy]Propanoic Acid
[CAS# 42558-77-0]

Identification

• Name: 3-[2-[Bis(2-Chloroethyl)Amino]Phenoxy]Propanoic Acid
• Synonyms: 3-[2-[Bis(2-Chloroethyl)Amino]Phenoxy]Propionic Acid; Nsc42343; Propionic Acid, 3-[2-[Bis(2-Chloroethyl)Amino]Phenoxy]-
• Molecular Formula: C₁₃H₁₇Cl₂NO₃
• Molecular Weight: 306.19
• CAS Registry Number: 42558-77-0
• SMILES: C1=CC=CC(=C1OCCC(O)=O)N(CCCl)CCCl
• InChI: 1S/C13H17Cl2NO3/c14-6-8-16(9-7-15)11-3-1-2-4-12(11)19-10-5-13(17)18/h1-4H,5-10H2,(H,17,18)
• InChIKey: HPLYMGFTQAKXEO-UHFFFAOYSA-N

Properties

• Density: 1.304g/cm³ (Cal.)
• Boiling point: 410.05°C at 760 mmHg (Cal.)
• Flash point: 201.791°C (Cal.)