4-Methylbenzenesulfonate;2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-amine

Base Information

• Chemical Name: 4-Methylbenzenesulfonate;2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-amine
• CAS No.: 136577-26-9
• Molecular Formula: C₇H₇O₃S*C₈H₁₃N₂S
• Molecular Weight: 340.467

Synonyms:SCHEMBL8800547

Chemical Property of 4-Methylbenzenesulfonate;2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-ium-3-amine

Chemical Property:

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 340.09153485
• Heavy Atom Count: 22
• Complexity: 344

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MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=[N+](C2=C(S1)CCCC2)N

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