Carbonimidothioic acid, 3-pyridinyl-, O-cyclohexyl S-((4-(1,1-dimethylethyl)phenyl)methyl) ester

Base Information

• Chemical Name: Carbonimidothioic acid, 3-pyridinyl-, O-cyclohexyl S-((4-(1,1-dimethylethyl)phenyl)methyl) ester
• CAS No.: 42754-16-5
• Molecular Formula: C23H30N2OS
• Molecular Weight: 382.61
• DSSTox Substance ID: DTXSID60962670
• Wikidata: Q82944390
• Mol file: 42754-16-5.mol

Synonyms:42754-16-5;Carbonimidothioic acid, 3-pyridinyl-, O-cyclohexyl S-((4-(1,1-dimethylethyl)phenyl)methyl) ester;DTXSID60962670;LS-52194;S-[(4-tert-Butylphenyl)methyl] hydrogen (2-cyclohexylpyridin-3-yl)carbonimidothioate

Chemical Property of Carbonimidothioic acid, 3-pyridinyl-, O-cyclohexyl S-((4-(1,1-dimethylethyl)phenyl)methyl) ester

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.13g/cm³
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 382.20788476
• Heavy Atom Count: 27
• Complexity: 462

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): Moderately toxic by ingestion.
• Hazard Codes: Moderately toxic by ingestion.

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)C1=CC=C(C=C1)CSC(=O)NC2=C(N=CC=C2)C3CCCCC3
• Uses: Agricultural chemical.

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