2-Chloromelatonin
[CAS# 118747-02-7]

Identification

• Name: 2-Chloromelatonin
• Synonyms: N-[2-(2-Chloro-5-Methoxy-1H-Indol-3-Yl)Ethyl]Ethanamide; 2-Chloromelatonin; Pdsp1_001794
• Molecular Formula: C₁₃H₁₅ClN₂O₂
• Molecular Weight: 266.73
• CAS Registry Number: 118747-02-7
• SMILES: C1=C(C=CC2=C1C(=C([NH]2)Cl)CCNC(C)=O)OC
• InChI: 1S/C13H15ClN2O2/c1-8(17)15-6-5-10-11-7-9(18-2)3-4-12(11)16-13(10)14/h3-4,7,16H,5-6H2,1-2H3,(H,15,17)
• InChIKey: NCUNCNOQCUAVBX-UHFFFAOYSA-N

Properties

• Density: 1.273g/cm³ (Cal.)
• Boiling point: 536.245°C at 760 mmHg (Cal.)
• Flash point: 278.111°C (Cal.)