N-[(1R,2S)-1-Amino-1-carboxy-2-propanyl]-L-histidine
[CAS# 88495-09-4]

Identification

• Name: N-[(1R,2S)-1-Amino-1-carboxy-2-propanyl]-L-histidine
• Synonyms: Histidinomethylalanine; L-Hmeal; N(tau)-(2'-Amino-2'-carboxy-1'-methylethyl)-L-histidine
• Molecular Formula: C₁₀H₁₆N₄O₄
• Molecular Weight: 256.26
• CAS Registry Number: 88495-09-4
• SMILES: O=C(O)[C@H](N)[C@@H](N[C@H](C(=O)O)Cc1cncn1)C
• InChI: 1S/C10H16N4O4/c1-5(8(11)10(17)18)14-7(9(15)16)2-6-3-12-4-13-6/h3-5,7-8,14H,2,11H2,1H3,(H,12,13)(H,15,16)(H,17,18)/t5-,7-,8+/m0/s1
• InChIKey: STJVSQOCSSJOLM-APQOSEDMSA-N

Properties

• Density: 1.43g/cm³ (Cal.)
• Boiling point: 616.764°C at 760 mmHg (Cal.)
• Flash point: 326.807°C (Cal.)