H-Ile-Val-OH
[CAS# 41017-96-3]

Identification

• Name: H-Ile-Val-OH
• Synonyms: (2S)-2-[[(2S,3S)-2-Amino-3-Methyl-Pentanoyl]Amino]-3-Methyl-Butanoic Acid; (2S)-2-[[(2S,3S)-2-Amino-3-Methyl-1-Oxopentyl]Amino]-3-Methylbutanoic Acid; (2S)-2-[[(2S,3S)-2-Amino-3-Methyl-Pentanoyl]Amino]-3-Methyl-Butyric Acid
• Molecular Formula: C₁₁H₂₂N₂O₃
• Molecular Weight: 230.31
• CAS Registry Number: 41017-96-3
• SMILES: [C@H](C(=O)O)(NC([C@@H](N)[C@H](CC)C)=O)C(C)C
• InChI: 1S/C11H22N2O3/c1-5-7(4)8(12)10(14)13-9(6(2)3)11(15)16/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)/t7-,8-,9-/m0/s1
• InChIKey: BCXBIONYYJCSDF-CIUDSAMLSA-N

Properties

• Density: 1.067g/cm³ (Cal.)
• Boiling point: 421.914°C at 760 mmHg (Cal.)
• Flash point: 208.966°C (Cal.)

References

• (1): Angiolina Comotti, Silvia Bracco, Gaetano Distefano and Piero Sozzani. Methane, carbon dioxide and hydrogen storage in nanoporous dipeptide-based materials, Chem. Commun., 2009, 284.