N-{[(1,1-Dioxido-1-Benzothiophen-3-Yl)Methoxy]Carbonyl}Glycine
[CAS# 197245-13-9]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Glycine derivatives
• Name: N-{[(1,1-Dioxido-1-Benzothiophen-3-Yl)Methoxy]Carbonyl}Glycine
• Synonyms: N-(Benzo[b]thiophenesulfone-2-methoxycarbonyl)aminoacetic acid; N-(Benzo[b]thiophenesulfone-2-methoxycarbonyl)glycine; N-Bsmoc-glycine
• Molecular Formula: C₁₂H₁₁NO₆S
• Molecular Weight: 297.28
• CAS Registry Number: 197245-13-9
• SMILES: C1=CC=C2C(=C1)C(=CS2(=O)=O)COC(=O)NCC(=O)O
• InChI: 1S/C12H11NO6S/c14-11(15)5-13-12(16)19-6-8-7-20(17,18)10-4-2-1-3-9(8)10/h1-4,7H,5-6H2,(H,13,16)(H,14,15)
• InChIKey: VWCUGFUWQVWBHM-UHFFFAOYSA-N

Properties

• Density: 1.473-1.593 (Expl.)
• Melting point: 161-163°C (Expl.)
• Boiling point: 619.3±55.0°C at 760 mmHg (Cal.)
• Flash point: 328.3±31.5°C (Cal.)
• Refractive index: 1.62 (Cal.)