(3E)-2,5-Diamino-2-ethynyl-3-pentenoic acid
[CAS# 774486-88-3]

Identification

• Name: (3E)-2,5-Diamino-2-ethynyl-3-pentenoic acid
• Synonyms: (R,E)-2,5-diamino-2-ethynylpent-3-enoic acid
• Molecular Formula: C₇H₁₀N₂O₂
• Molecular Weight: 154.17
• CAS Registry Number: 774486-88-3
• SMILES: NC\C=C\C(N)(C#C)C(O)=O
• InChI: 1S/C7H10N2O2/c1-2-7(9,6(10)11)4-3-5-8/h1,3-4H,5,8-9H2,(H,10,11)/b4-3+
• InChIKey: RELZRRUTLXPXNC-ONEGZZNKSA-N

Properties

• Density: 1.248g/cm³ (Cal.)
• Boiling point: 363.618°C at 760 mmHg (Cal.)
• Flash point: 173.71°C (Cal.)
• Refractive index: 1.577 (Cal.)