N-[(9H-Fluoren-9-Ylmethoxy)Carbonyl]-L-Alanine
[CAS 207291-76-7]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Alanine derivatives
• Name: N-[(9H-Fluoren-9-Ylmethoxy)Carbonyl]-L-Alanine
• Synonyms: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid; (2S)-2-[(fluoren-9-ylmethoxy)carbonylamino]propanoic acid; (S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)propanoic acid
• Molecular Formula: C₁₈H₁₇NO₄
• Molecular Weight: 311.33
• CAS Registry Number: 207291-76-7
• SMILES: C[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• InChI: 1S/C18H17NO4/c1-11(17(20)21)19-18(22)23-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H,19,22)(H,20,21)/t11-/m0/s1
• InChIKey: QWXZOFZKSQXPDC-NSHDSACASA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 130°C (Expl.)
• Boiling point: 544.1±33.0°C at 760 mmHg (Cal.)
• Flash point: 282.9±25.4°C (Cal.)
• Refractive index: 1.608 (Cal.)
• solubility: 25 mmole in 50 ml DMF clearly soluble

Safety Data

• Safety Description: CAUTION: May irritate eyes, skin, and respiratory tract

References

• (1): S. S. Golotvin, E. Vodopianov, R. Pol, B. A. Lefebvre, A. J. Williams, R. D. Rutkowske and T. D. Spitzer. Automated structure verification based on a combination of 1D 1H NMR and 2D 1H–13C HSQC spectra, Magn. Reson. Chem. 2007, 45, 803–813