4-(Bis(2-Chloroethyl)Amino)-Phenol 4-Fluorobenzoate
[CAS# 22953-56-6]

Identification

• Name: 4-(Bis(2-Chloroethyl)Amino)-Phenol 4-Fluorobenzoate
• Synonyms: 4-Fluorobenzoic Acid [4-[Bis(2-Chloroethyl)Amino]Phenyl] Ester; Benzoic Acid, P-Fluoro-, P-(Bis(2-Chloroethyl)Amino)Phenyl Ester; Phenol, P-(Bis(2-Chloroethyl)Amino)-, P-Fluorobenzoate
• Molecular Formula: C₁₇H₁₆Cl₂FNO₂
• Molecular Weight: 356.22
• CAS Registry Number: 22953-56-6
• SMILES: C1=CC(=CC=C1F)C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl
• InChI: 1S/C17H16Cl2FNO2/c18-9-11-21(12-10-19)15-5-7-16(8-6-15)23-17(22)13-1-3-14(20)4-2-13/h1-8H,9-12H2
• InChIKey: DFINKRRPZPLYKC-UHFFFAOYSA-N

Properties

• Density: 1.315g/cm³ (Cal.)
• Boiling point: 486.654°C at 760 mmHg (Cal.)
• Flash point: 248.12°C (Cal.)