(3-{[(4-Fluorophenyl)sulfonyl](methyl)amino}-1,2,3,4-tetrahydro-9H-carbazol-9-yl)acetic acid
[CAS 627865-18-3]

Identification

• Name: (3-{[(4-Fluorophenyl)sulfonyl](methyl)amino}-1,2,3,4-tetrahydro-9H-carbazol-9-yl)acetic acid
• Synonyms: "(+)-3-[[(4-fluorophenyl)sulfonyl]methylamino]-1,2,3,4-tetrahydro-9H-carbazole-9-acetic acid"; (+)-3-[[(4-fluorophenyl)sulfonyl]methylamino]-1,2,3,4-tetrahydro-9H-carbazole-9-acetic acid; CAY10471
• Molecular Formula: C₂₁H₂₁FN₂O₄S
• Molecular Weight: 416.47
• CAS Registry Number: 627865-18-3
• SMILES: CN(C1CCC2=C(C1)C3=CC=CC=C3N2CC(=O)O)S(=O)(=O)C4=CC=C(C=C4)F
• InChI: 1S/C21H21FN2O4S/c1-23(29(27,28)16-9-6-14(22)7-10-16)15-8-11-20-18(12-15)17-4-2-3-5-19(17)24(20)13-21(25)26/h2-7,9-10,15H,8,11-13H2,1H3,(H,25,26)
• InChIKey: CANCTKXGRVNXFP-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 639.1±65.0°C at 760 mmHg (Cal.)
• Flash point: 340.3±34.3°C (Cal.)
• Refractive index: 1.655 (Cal.)