[4-[Bis(2-Chloroethyl)Amino]Phenyl] 3-Fluorobenzoate
[CAS# 22953-55-5]

Identification

• Name: [4-[Bis(2-Chloroethyl)Amino]Phenyl] 3-Fluorobenzoate
• Synonyms: 3-Fluorobenzoic Acid [4-[Bis(2-Chloroethyl)Amino]Phenyl] Ester; P-(Bis(2-Chloroethyl)Amino)Phenyl M-Fluorobenzoate; Brn 2767666
• Molecular Formula: C₁₇H₁₆Cl₂FNO₂
• Molecular Weight: 356.22
• CAS Registry Number: 22953-55-5
• SMILES: C1=CC=C(C=C1F)C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl
• InChI: 1S/C17H16Cl2FNO2/c18-8-10-21(11-9-19)15-4-6-16(7-5-15)23-17(22)13-2-1-3-14(20)12-13/h1-7,12H,8-11H2
• InChIKey: WNHQFWFQAJPQMC-UHFFFAOYSA-N

Properties

• Density: 1.315g/cm³ (Cal.)
• Boiling point: 485.916°C at 760 mmHg (Cal.)
• Flash point: 247.674°C (Cal.)