1-[2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]-3-Isopropylurea
[CAS# 93856-91-8]

Identification

• Name: 1-[2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]-3-Isopropylurea
• Synonyms: 1-[2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]-3-Isopropyl-Urea; 1-[2-Hydroxy-1-(Hydroxymethyl)-2-(4-Nitrophenyl)Ethyl]-3-Isopropylurea; 1-[2-Hydroxy-1-Methylol-2-(4-Nitrophenyl)Ethyl]-3-Isopropyl-Urea
• Molecular Formula: C₁₃H₁₉N₃O₅
• Molecular Weight: 297.31
• CAS Registry Number: 93856-91-8
• EINECS: 299-125-3
• SMILES: C1=C(C(O)C(NC(=O)NC(C)C)CO)C=CC(=C1)[N+]([O-])=O
• InChI: 1S/C13H19N3O5/c1-8(2)14-13(19)15-11(7-17)12(18)9-3-5-10(6-4-9)16(20)21/h3-6,8,11-12,17-18H,7H2,1-2H3,(H2,14,15,19)
• InChIKey: JPSUYHCCZCEGKQ-UHFFFAOYSA-N

Properties

• Density: 1.305g/cm³ (Cal.)
• Boiling point: 589.338°C at 760 mmHg (Cal.)
• Flash point: 310.221°C (Cal.)