1-Methyl-2-(methylthio)naphtho(1,2-d)-thiazolium 4-methylbenzenesulfonate

Base Information

• Chemical Name: 1-Methyl-2-(methylthio)naphtho(1,2-d)-thiazolium 4-methylbenzenesulfonate
• CAS No.: 63149-20-2
• Molecular Formula: C20H19NO3S3
• Molecular Weight: 417.5648
• DSSTox Substance ID: DTXSID7069738

Synonyms:1-Methyl-2-(methylthio)naphtho(1,2-d)-thiazolium 4-methylbenzenesulfonate;63149-20-2;Naphtho(1,2-d)thiazolium, 1-methyl-2-(methylthio)-, 4-methylbenzenesulfonate (1:1);Naphtho(1,2-d)thiazolium, 1-methyl-2-(methylthio)-, salt with 4-methylbenzenesulfonic acid (1:1);Naphtho[1,2-d]thiazolium, 1-methyl-2-(methylthio)-, salt with 4-methylbenzenesulfonic acid (1:1);SCHEMBL5178713;DTXSID7069738;C13H12NS2.C7H7O3S;C13-H12-N-S2.C7-H7-O3-S

Chemical Property of 1-Methyl-2-(methylthio)naphtho(1,2-d)-thiazolium 4-methylbenzenesulfonate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 123.00000
• Density: g/cm³
• LogP: 5.58080
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 417.05270699
• Heavy Atom Count: 27
• Complexity: 451

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)SC

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