3-[[[4-[(2-Furoyl)Amino]-3-Hydroxyphenyl]Amino]Carbonyl]Nonadec-5-Enoic Acid
[CAS# 29337-98-2]

Identification

• Name: 3-[[[4-[(2-Furoyl)Amino]-3-Hydroxyphenyl]Amino]Carbonyl]Nonadec-5-Enoic Acid
• Synonyms: (E)-3-[[4-(Furan-2-Carbonylamino)-3-Hydroxy-Phenyl]Carbamoyl]Nonadec-5-Enoic Acid; (E)-3-[[[4-[(2-Furyl-Oxomethyl)Amino]-3-Hydroxyphenyl]Amino]-Oxomethyl]Nonadec-5-Enoic Acid; (E)-3-[[4-(Furan-2-Ylcarbonylamino)-3-Hydroxy-Phenyl]Carbamoyl]Nonadec-5-Enoic Acid
• Molecular Formula: C₃₁H₄₄N₂O₆
• Molecular Weight: 540.70
• CAS Registry Number: 29337-98-2
• EINECS: 249-570-4
• SMILES: C1=C(NC(=O)C(CC(=O)O)C\C=C\CCCCCCCCCCCCC)C=CC(=C1O)NC(=O)C2=CC=CO2
• InChI: 1S/C31H44N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24(22-29(35)36)30(37)32-25-19-20-26(27(34)23-25)33-31(38)28-18-16-21-39-28/h14-16,18-21,23-24,34H,2-13,17,22H2,1H3,(H,32,37)(H,33,38)(H,35,36)/b15-14+
• InChIKey: LWPNEFYVMBUAID-CCEZHUSRSA-N

Properties

• Density: 1.154g/cm³ (Cal.)
• Boiling point: 666.281°C at 760 mmHg (Cal.)
• Flash point: 356.754°C (Cal.)