N-Formyl-L-Aspartic acid 4-benzyl ester
[CAS# 5513-72-4]

Identification

• Name: N-Formyl-L-Aspartic acid 4-benzyl ester
• Synonyms: (3S)-4-(Benzyloxy)-3-Formamido-4-Keto-Butyric Acid; 4-Benzyl Hydrogen N-Formyl-L-Aspartate
• Molecular Formula: C₁₂H₁₃NO₅
• Molecular Weight: 251.24
• CAS Registry Number: 5513-72-4
• EINECS: 226-858-8
• SMILES: [C@H](CC(=O)O)(C(OCC1=CC=CC=C1)=O)NC=O
• InChI: 1S/C12H13NO5/c14-8-13-10(6-11(15)16)12(17)18-7-9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,13,14)(H,15,16)/t10-/m0/s1
• InChIKey: VBVOXHBCUVICCE-JTQLQIEISA-N

Properties

• Density: 1.302g/cm³ (Cal.)
• Boiling point: 530.27°C at 760 mmHg (Cal.)
• Flash point: 274.498°C (Cal.)