2-(5-methoxy-1H-indol-3-yl)ethanol;2,4,6-trinitrophenol

Base Information

• Chemical Name: 2-(5-methoxy-1H-indol-3-yl)ethanol;2,4,6-trinitrophenol
• CAS No.: 985-54-6
• Molecular Formula: C17H16N4O9
• Molecular Weight: 420.3303
• NSC Number: 84415
• DSSTox Substance ID: DTXSID90292654

Synonyms:985-54-6;NSC84415;DTXSID90292654;NSC-84415;2,4,6-Trinitrophenol--2-(5-methoxy-1H-indol-3-yl)ethan-1-ol (1/1)

Chemical Property of 2-(5-methoxy-1H-indol-3-yl)ethanol;2,4,6-trinitrophenol

Chemical Property:

• Vapor Pressure: 0.000514mmHg at 25°C
• Boiling Point: 303.6°C at 760 mmHg
• Flash Point: 133.9°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 420.09172810
• Heavy Atom Count: 30
• Complexity: 478

Purity/Quality:

99% ^*data from raw suppliers

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)NC=C2CCO.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

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