4-[[2-[(4-Butoxybenzoyl)Amino]-3-Phenylpropanoyl]Amino]Butanoic Acid
[CAS# 172798-63-9]

Identification

• Name: 4-[[2-[(4-Butoxybenzoyl)Amino]-3-Phenylpropanoyl]Amino]Butanoic Acid
• Synonyms: 4-[[2-[(4-Butoxybenzoyl)Amino]-3-Phenyl-Propanoyl]Amino]Butanoic Acid; 4-[[2-[[(4-Butoxyphenyl)-Oxomethyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]Butanoic Acid; 4-[[2-[(4-Butoxybenzoyl)Amino]-3-Phenyl-Propanoyl]Amino]Butyric Acid
• Molecular Formula: C₂₄H₃₀N₂O₅
• Molecular Weight: 426.51
• CAS Registry Number: 172798-63-9
• SMILES: C1=CC=CC=C1CC(C(NCCCC(=O)O)=O)NC(C2=CC=C(C=C2)OCCCC)=O
• InChI: 1S/C24H30N2O5/c1-2-3-16-31-20-13-11-19(12-14-20)23(29)26-21(17-18-8-5-4-6-9-18)24(30)25-15-7-10-22(27)28/h4-6,8-9,11-14,21H,2-3,7,10,15-17H2,1H3,(H,25,30)(H,26,29)(H,27,28)
• InChIKey: IZBGNACBQJWBBQ-UHFFFAOYSA-N

Properties

• Density: 1.172g/cm³ (Cal.)
• Boiling point: 728.014°C at 760 mmHg (Cal.)
• Flash point: 394.089°C (Cal.)