2-(((4-Methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-3H-indolium hydrogen sulphate

Base Information

• Chemical Name: 2-(((4-Methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-3H-indolium hydrogen sulphate
• CAS No.: 83969-01-1
• Molecular Formula: C20H24N4O7S
• Molecular Weight: 464.49216
• European Community (EC) Number: 281-577-8
• Mol file: 83969-01-1.mol

Synonyms:EINECS 281-577-8;83969-01-1;2-(((4-Methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-3H-indolium hydrogen sulphate

Chemical Property of 2-(((4-Methoxyphenyl)methylhydrazono)methyl)-1,3,3-trimethyl-5-nitro-3H-indolium hydrogen sulphate

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 5
• Exact Mass: 464.13657029
• Heavy Atom Count: 32
• Complexity: 679

Purity/Quality:

99% ^*data from raw suppliers

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Useful:

• Canonical SMILES: CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1C=NNCC3=CC=C(C=C3)OC)C)C.OS(=O)(=O)[O-]
• Isomeric SMILES: CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1/C=N/NCC3=CC=C(C=C3)OC)C)C.OS(=O)(=O)[O-]

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