4-[Bis(2-Chloroethyl)Amino]-M-Toluic Acid
[CAS# 17183-23-2]

Identification

• Name: 4-[Bis(2-Chloroethyl)Amino]-M-Toluic Acid
• Synonyms: 4-[Bis(2-Chloroethyl)Amino]-3-Methyl-Benzoic Acid; 4-Bis(2-Chloroethyl)Amino-3-Methylbenzoic Acid; 4-Bis(2-Chloroethyl)Amino-M-Toluic Acid
• Molecular Formula: C₁₂H₁₅Cl₂NO₂
• Molecular Weight: 276.16
• CAS Registry Number: 17183-23-2
• SMILES: C1=C(C=CC(=C1C)N(CCCl)CCCl)C(O)=O
• InChI: 1S/C12H15Cl2NO2/c1-9-8-10(12(16)17)2-3-11(9)15(6-4-13)7-5-14/h2-3,8H,4-7H2,1H3,(H,16,17)
• InChIKey: UPHRSVSGLFZJPR-UHFFFAOYSA-N

Properties

• Density: 1.303g/cm³ (Cal.)
• Boiling point: 426.283°C at 760 mmHg (Cal.)
• Flash point: 211.609°C (Cal.)