4-[[4-[Bis(2-Chloroethyl)Amino]Phenoxy]Carbonylamino]Benzoic Acid
[CAS# 148-78-7]

Identification

• Name: 4-[[4-[Bis(2-Chloroethyl)Amino]Phenoxy]Carbonylamino]Benzoic Acid
• Synonyms: 4-[[[4-[Bis(2-Chloroethyl)Amino]Phenoxy]-Oxomethyl]Amino]Benzoic Acid; Carbanilic Acid, P-Carboxy-, (4-(Bis(2-Chloroethyl)Amino)Phenyl); Carbanilic Acid, P-Carboxy-, N-(P-(Bis(2-Chloroethyl)Amino)Phenyl) Ester (8Ci)
• Molecular Formula: C₁₈H₁₈Cl₂N₂O₄
• Molecular Weight: 397.26
• CAS Registry Number: 148-78-7
• SMILES: C1=C(N(CCCl)CCCl)C=CC(=C1)OC(NC2=CC=C(C=C2)C(O)=O)=O
• InChI: 1S/C18H18Cl2N2O4/c19-9-11-22(12-10-20)15-5-7-16(8-6-15)26-18(25)21-14-3-1-13(2-4-14)17(23)24/h1-8H,9-12H2,(H,21,25)(H,23,24)
• InChIKey: CNLVZUPSGAAHAO-UHFFFAOYSA-N

Properties

• Density: 1.415g/cm³ (Cal.)
• Boiling point: 565.879°C at 760 mmHg (Cal.)
• Flash point: 296.033°C (Cal.)