(5Z)-2,10-Diamino-5-[[4-(2-amino-2-carboxy-ethyl)imidazol-1-yl]methylidene]-7-hydroxy-undecanedioic acid
[CAS# 57944-40-8]

Identification

• Name: (5Z)-2,10-Diamino-5-[[4-(2-amino-2-carboxy-ethyl)imidazol-1-yl]methylidene]-7-hydroxy-undecanedioic acid
• Synonyms: (5Z)-2,10-Diamino-5-[[4-(2-Amino-3-Hydroxy-3-Oxo-Propyl)Imidazol-1-Yl]Methylene]-7-Hydroxy-Undecanedioic Acid; (5Z)-2,10-Diamino-5-[[4-(2-Amino-3-Hydroxy-3-Oxopropyl)-1-Imidazolyl]Methylene]-7-Hydroxyundecanedioic Acid; (5Z)-2,10-Diamino-5-[[4-(2-Amino-3-Hydroxy-3-Keto-Propyl)Imidazol-1-Yl]Methylene]-7-Hydroxy-Undecanedioic Acid
• Molecular Formula: C₁₈H₂₉N₅O₇
• Molecular Weight: 427.46
• CAS Registry Number: 57944-40-8
• SMILES: C1=NC(=C[N]1/C=C(/CCC(C(=O)O)N)CC(CCC(C(=O)O)N)O)CC(C(=O)O)N
• InChI: 1S/C18H29N5O7/c19-13(16(25)26)3-1-10(5-12(24)2-4-14(20)17(27)28)7-23-8-11(22-9-23)6-15(21)18(29)30/h7-9,12-15,24H,1-6,19-21H2,(H,25,26)(H,27,28)(H,29,30)/b10-7-
• InChIKey: ZNGHQRPBUWYFHI-YFHOEESVSA-N

Properties

• Density: 1.524g/cm³ (Cal.)
• Boiling point: 812.613°C at 760 mmHg (Cal.)
• Flash point: 445.253°C (Cal.)