4-(2-Chloroethyl-Ethylamino)Benzoic Acid
[CAS# 2045-21-8]

Identification

• Name: 4-(2-Chloroethyl-Ethylamino)Benzoic Acid
• Synonyms: 4-(2-Chloroethyl-Ethyl-Amino)Benzoic Acid; Benzoic Acid, P-(N-(2-Chloroethyl)-N-Ethylamino)-; Brn 2808660
• Molecular Formula: C₁₁H₁₄ClNO₂
• Molecular Weight: 227.69
• CAS Registry Number: 2045-21-8
• SMILES: C1=C(N(CCCl)CC)C=CC(=C1)C(O)=O
• InChI: 1S/C11H14ClNO2/c1-2-13(8-7-12)10-5-3-9(4-6-10)11(14)15/h3-6H,2,7-8H2,1H3,(H,14,15)
• InChIKey: ULODYZDCGAFRDQ-UHFFFAOYSA-N

Properties

• Density: 1.235g/cm³ (Cal.)
• Boiling point: 384.533°C at 760 mmHg (Cal.)
• Flash point: 186.359°C (Cal.)