[4-[Bis(2-Chloroethyl)Amino]Phenyl] 2-Methylbenzoate
[CAS# 21667-00-5]

Identification

• Name: [4-[Bis(2-Chloroethyl)Amino]Phenyl] 2-Methylbenzoate
• Synonyms: 2-Methylbenzoic Acid [4-[Bis(2-Chloroethyl)Amino]Phenyl] Ester; Brn 2766110; Benzoic Acid, O-Methyl-, P-(Bis(2-Chloroethyl)Amino)Phenyl Ester
• Molecular Formula: C₁₈H₁₉Cl₂NO₂
• Molecular Weight: 352.26
• CAS Registry Number: 21667-00-5
• SMILES: C1=CC=CC(=C1C)C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl
• InChI: 1S/C18H19Cl2NO2/c1-14-4-2-3-5-17(14)18(22)23-16-8-6-15(7-9-16)21(12-10-19)13-11-20/h2-9H,10-13H2,1H3
• InChIKey: KRRMOOMFGMSJHJ-UHFFFAOYSA-N

Properties

• Density: 1.245g/cm³ (Cal.)
• Boiling point: 498.012°C at 760 mmHg (Cal.)
• Flash point: 254.989°C (Cal.)