1-(4'-tert-Butylphenyl)-3-(4'carboxymethylaminocarbonylphenoxy)-2-propanol
[CAS# 96609-38-0]

Identification

• Name: 1-(4'-tert-Butylphenyl)-3-(4'carboxymethylaminocarbonylphenoxy)-2-propanol
• Synonyms: 2-[[4-[3-(4-Tert-Butylphenyl)-2-Hydroxy-Propoxy]Benzoyl]Amino]Acetic Acid; 2-[[[4-[3-(4-Tert-Butylphenyl)-2-Hydroxypropoxy]Phenyl]-Oxomethyl]Amino]Acetic Acid; 2-[[4-[3-(4-Tert-Butylphenyl)-2-Hydroxy-Propoxy]Phenyl]Carbonylamino]Ethanoic Acid
• Molecular Formula: C₂₂H₂₇NO₅
• Molecular Weight: 385.46
• CAS Registry Number: 96609-38-0
• SMILES: C1=CC(=CC=C1C(C)(C)C)CC(O)COC2=CC=C(C=C2)C(=O)NCC(O)=O
• InChI: 1S/C22H27NO5/c1-22(2,3)17-8-4-15(5-9-17)12-18(24)14-28-19-10-6-16(7-11-19)21(27)23-13-20(25)26/h4-11,18,24H,12-14H2,1-3H3,(H,23,27)(H,25,26)
• InChIKey: OITQFUOXILLSLL-UHFFFAOYSA-N

Properties

• Density: 1.193g/cm³ (Cal.)
• Boiling point: 636.351°C at 760 mmHg (Cal.)
• Flash point: 338.653°C (Cal.)