4-Aminobenzoyloxyethyldiethylammonium 2-(4-Chlorophenoxy)-2-Methylpropionate
[CAS# 42016-66-0]

Identification

• Name: 4-Aminobenzoyloxyethyldiethylammonium 2-(4-Chlorophenoxy)-2-Methylpropionate
• Synonyms: 2-(4-Chlorophenoxy)-2-Methyl-Propanoic Acid; 2-Diethylaminoethyl 4-Aminobenzoate; 4-Aminobenzoic Acid 2-Diethylaminoethyl Ester; 2-(4-Chlorophenoxy)-2-Methylpropanoic Acid; 4-Aminobenzoic Acid 2-Diethylaminoethyl Ester; 2-(4-Chlorophenoxy)-2-Methyl-Propionic Acid
• Molecular Formula: C₂₃H₃₁ClN₂O₅
• Molecular Weight: 450.96
• CAS Registry Number: 42016-66-0
• EINECS: 255-624-8
• SMILES: C1=C(OC(C(=O)O)(C)C)C=CC(=C1)Cl.C2=C(C(OCCN(CC)CC)=O)C=CC(=C2)N
• InChI: 1S/C13H20N2O2.C10H11ClO3/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11;1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h5-8H,3-4,9-10,14H2,1-2H3;3-6H,1-2H3,(H,12,13)
• InChIKey: HDFNRSMLACSMOH-UHFFFAOYSA-N

Properties

• Boiling point: 373.6°C at 760 mmHg (Cal.)
• Flash point: 179.8°C (Cal.)