[4-(Bis(2-Bromoethyl)Amino)Phenyl] 4-Methylbenzoate
[CAS# 22954-16-1]

Identification

• Name: [4-(Bis(2-Bromoethyl)Amino)Phenyl] 4-Methylbenzoate
• Synonyms: 4-Methylbenzoic Acid [4-(Bis(2-Bromoethyl)Amino)Phenyl] Ester; Brn 3066989; Benzoic Acid, P-Methyl-, P-(Bis(2-Bromoethyl)Amino)Phenyl Ester
• Molecular Formula: C₁₈H₁₉Br₂NO₂
• Molecular Weight: 441.16
• CAS Registry Number: 22954-16-1
• SMILES: C1=CC(=CC=C1C)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr
• InChI: 1S/C18H19Br2NO2/c1-14-2-4-15(5-3-14)18(22)23-17-8-6-16(7-9-17)21(12-10-19)13-11-20/h2-9H,10-13H2,1H3
• InChIKey: HETTWOPRDUZXMX-UHFFFAOYSA-N

Properties

• Density: 1.54g/cm³ (Cal.)
• Boiling point: 521.152°C at 760 mmHg (Cal.)
• Flash point: 268.983°C (Cal.)