3-(N,N-Bis(2-chloropropyl)amino)-4-methyl-Benzoic acid
[CAS# 54941-23-0]

Identification

• Name: 3-(N,N-Bis(2-chloropropyl)amino)-4-methyl-Benzoic acid
• Synonyms: 3-(Bis(2-Chloropropyl)Amino)-4-Methyl-Benzoic Acid; P-Toluic Acid, 3-(Bis(2-Chloropropyl)Amino)-; 3-(Bis(2-Chloropropyl)Amino)-P-Toluic Acid
• Molecular Formula: C₁₄H₁₉Cl₂NO₂
• Molecular Weight: 304.22
• CAS Registry Number: 54941-23-0
• SMILES: C1=C(C(=CC=C1C(=O)O)C)N(CC(Cl)C)CC(Cl)C
• InChI: 1S/C14H19Cl2NO2/c1-9-4-5-12(14(18)19)6-13(9)17(7-10(2)15)8-11(3)16/h4-6,10-11H,7-8H2,1-3H3,(H,18,19)
• InChIKey: JHKAMWMWNMZLLS-UHFFFAOYSA-N

Properties

• Density: 1.238g/cm³ (Cal.)
• Boiling point: 448.822°C at 760 mmHg (Cal.)
• Flash point: 225.24°C (Cal.)