1-(4-Chlorophenyl)-2-methylbut-3-ene-1,2-diol

Base Information

• Chemical Name: 1-(4-Chlorophenyl)-2-methylbut-3-ene-1,2-diol
• CAS No.: 56790-68-2
• Molecular Formula: C11H13ClO2
• Molecular Weight: 212.67300
• DSSTox Substance ID: DTXSID50532826

Synonyms:1-(4-Chlorophenyl)-2-methylbut-3-ene-1,2-diol;56790-68-2;DTXSID50532826

Chemical Property of 1-(4-Chlorophenyl)-2-methylbut-3-ene-1,2-diol

Chemical Property:

• Boiling Point: 349.9±37.0 °C(Predicted)
• PSA: 40.46000
• Density: 1.217±0.06 g/cm3(Predicted)
• LogP: 2.31040
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 212.0604073
• Heavy Atom Count: 14
• Complexity: 200

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C=C)(C(C1=CC=C(C=C1)Cl)O)O

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