3-[Bis(2-Chloroethyl)Amino]-p-Toluic Acid 2-(Diethylamino)Ethyl Ester
[CAS# 58278-35-6]

Identification

• Name: 3-[Bis(2-Chloroethyl)Amino]-p-Toluic Acid 2-(Diethylamino)Ethyl Ester
• Synonyms: 2-Diethylaminoethyl 3-[Bis(2-Chloroethyl)Amino]-4-Methyl-Benzoate; 3-[Bis(2-Chloroethyl)Amino]-4-Methylbenzoic Acid 2-Diethylaminoethyl Ester; 3-[Bis(2-Chloroethyl)Amino]-4-Methyl-Benzoic Acid 2-Diethylaminoethyl Ester
• Molecular Formula: C₁₈H₂₈Cl₂N₂O₂
• Molecular Weight: 375.34
• CAS Registry Number: 58278-35-6
• SMILES: C1=C(C(OCCN(CC)CC)=O)C=CC(=C1N(CCCl)CCCl)C
• InChI: 1S/C18H28Cl2N2O2/c1-4-21(5-2)12-13-24-18(23)16-7-6-15(3)17(14-16)22(10-8-19)11-9-20/h6-7,14H,4-5,8-13H2,1-3H3
• InChIKey: SUXXQPYIEOMRBY-UHFFFAOYSA-N

Properties

• Density: 1.147g/cm³ (Cal.)
• Boiling point: 483.43°C at 760 mmHg (Cal.)
• Flash point: 246.17°C (Cal.)