Propanedioic acid, 1,3-dithiol-2-ylidene-, methyl 2-methylpropyl ester

Base Information

• Chemical Name: Propanedioic acid, 1,3-dithiol-2-ylidene-, methyl 2-methylpropyl ester
• CAS No.: 59937-40-5
• Molecular Formula: C11H14O4S2
• Molecular Weight: 274.35600
• DSSTox Substance ID: DTXSID70431887

Synonyms:59937-40-5;Propanedioic acid, 1,3-dithiol-2-ylidene-, methyl 2-methylpropyl ester;SCHEMBL11700838;DTXSID70431887

Chemical Property of Propanedioic acid, 1,3-dithiol-2-ylidene-, methyl 2-methylpropyl ester

Chemical Property:

• Boiling Point: 310.3±42.0 °C(Predicted)
• PSA: 103.20000
• Density: 1.289±0.06 g/cm3(Predicted)
• LogP: 2.52140
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 274.03335127
• Heavy Atom Count: 17
• Complexity: 362

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)COC(=O)C(=C1SC=CS1)C(=O)OC

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