3-(4-(1-(4-Methoxyphenyl)-2-nitro-2-phenylethenyl)phenoxy)-N,N-dimethyl-1-propanamine monocitrate
[CAS# 56287-31-1]

Identification

• Name: 3-(4-(1-(4-Methoxyphenyl)-2-nitro-2-phenylethenyl)phenoxy)-N,N-dimethyl-1-propanamine monocitrate
• Synonyms: Citric Acid; 3-[4-[(Z)-1-(4-Methoxyphenyl)-2-Nitro-2-Phenyl-Vinyl]Phenoxy]-N,N-Dimethyl-Propan-1-Amine; Citric Acid; 3-[4-[(Z)-1-(4-Methoxyphenyl)-2-Nitro-2-Phenylvinyl]Phenoxy]-N,N-Dimethylpropan-1-Amine; Citric Acid; 3-[4-[(Z)-1-(4-Methoxyphenyl)-2-Nitro-2-Phenyl-Vinyl]Phenoxy]Propyl-Dimethyl-Amine
• Molecular Formula: C₃₂H₃₆N₂O₁₁
• Molecular Weight: 624.64
• CAS Registry Number: 56287-31-1
• SMILES: C3=C(\C(=C([N+]([O-])=O)\C1=CC=CC=C1)C2=CC=C(OC)C=C2)C=CC(=C3)OCCCN(C)C.C(C(O)(C(=O)O)CC(=O)O)C(=O)O
• InChI: 1S/C26H28N2O4.C6H8O7/c1-27(2)18-7-19-32-24-16-12-21(13-17-24)25(20-10-14-23(31-3)15-11-20)26(28(29)30)22-8-5-4-6-9-22;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-6,8-17H,7,18-19H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b26-25-
• InChIKey: STAHNFFHFRNPMD-OQKDUQJOSA-N

Properties

• Boiling point: 551°C at 760 mmHg (Cal.)
• Flash point: 287°C (Cal.)