3-nitro-10H-phenothiazine

Base Information

• Chemical Name: 3-nitro-10H-phenothiazine
• CAS No.: 1628-77-9
• Molecular Formula: C₁₂H₈N₂O₂S
• Molecular Weight: 244.274
• NSC Number: 675587
• DSSTox Substance ID: DTXSID601312159
• Pharos Ligand ID: JT96GHXVW2WF
• ChEMBL ID: CHEMBL1976750
• Mol file: 1628-77-9.mol

Synonyms:3-nitro-10H-phenothiazine;NSC675587;CHEMBL1976750;C12H8N2O2S;3-nitrophenothiazine;1628-77-9;SCHEMBL239724;CLXYGCPNHLXLPD-UHFFFAOYSA-N;DTXSID601312159;BDBM50389291;NSC-675587;NCI60_026698;3-(Hydroxy(oxido)amino)-10H-phenothiazine

Chemical Property of 3-nitro-10H-phenothiazine

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 244.03064868
• Heavy Atom Count: 17
• Complexity: 307

Purity/Quality:

95% ^*data from raw suppliers

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

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