3-(2,5-Dimethoxyphenyl)propyl p-toluenesulfonate

Base Information

• Chemical Name: 3-(2,5-Dimethoxyphenyl)propyl p-toluenesulfonate
• CAS No.: 72018-07-6
• Molecular Formula: C18H22O5S
• Molecular Weight: 350.43
• DSSTox Substance ID: DTXSID70888034
• Nikkaji Number: J447.013C
• Wikidata: Q82867481
• Mol file: 72018-07-6.mol

Synonyms:72018-07-6;3-(2,5-Dimethoxyphenyl)propyl p-toluenesulfonate;Benzenepropanol, 2,5-dimethoxy-, 4-methylbenzenesulfonate;Benzenepropanol, 2,5-dimethoxy-, 1-(4-methylbenzenesulfonate);DTXSID70888034;2,5-Dimethoxyphenylpropyl-4-toluene sulfonate;4-Methylbenzenesulfonic acid 3-(2,5-dimethoxyphenyl)propyl ester

Chemical Property of 3-(2,5-Dimethoxyphenyl)propyl p-toluenesulfonate

Chemical Property:

• Vapor Pressure: 8.46E-10mmHg at 25°C
• Boiling Point: 504.3°C at 760 mmHg
• Flash Point: 258.8°C
• PSA: 70.21000
• Density: 1.185g/cm³
• LogP: 4.43110
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 350.11879497
• Heavy Atom Count: 24
• Complexity: 451

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=C(C=CC(=C2)OC)OC

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