N-(N-(3,4,5-Trimethoxybenzoyl)-4-(2,6-Dimethylanilino)Butyryl)-4-Amino-Butyric Acid
[CAS# 71455-69-1]

Identification

• Name: N-(N-(3,4,5-Trimethoxybenzoyl)-4-(2,6-Dimethylanilino)Butyryl)-4-Amino-Butyric Acid
• Synonyms: 4-[[4-[(2,6-Dimethylphenyl)-[Oxo-(3,4,5-Trimethoxyphenyl)Methyl]Amino]-1-Oxobutyl]Amino]Butanoic Acid; 4-[4-[(2,6-Dimethylphenyl)-(3,4,5-Trimethoxybenzoyl)Amino]Butanoylamino]Butyric Acid; 4-[4-[(2,6-Dimethylphenyl)-(3,4,5-Trimethoxyphenyl)Carbonyl-Amino]Butanoylamino]Butanoic Acid
• Molecular Formula: C₂₆H₃₄N₂O₇
• Molecular Weight: 486.56
• CAS Registry Number: 71455-69-1
• SMILES: C1=C(C(=C(C=C1C(N(CCCC(NCCCC(=O)O)=O)C2=C(C=CC=C2C)C)=O)OC)OC)OC
• InChI: 1S/C26H34N2O7/c1-17-9-6-10-18(2)24(17)28(14-8-11-22(29)27-13-7-12-23(30)31)26(32)19-15-20(33-3)25(35-5)21(16-19)34-4/h6,9-10,15-16H,7-8,11-14H2,1-5H3,(H,27,29)(H,30,31)
• InChIKey: WERXNDIDOBSEFG-UHFFFAOYSA-N

Properties

• Density: 1.194g/cm³ (Cal.)
• Boiling point: 740.359°C at 760 mmHg (Cal.)
• Flash point: 401.555°C (Cal.)