6,6-Dimethylbicyclo[3.1.0]hexan-3-one

Base Information

• Chemical Name: 6,6-Dimethylbicyclo[3.1.0]hexan-3-one
• CAS No.: 13855-29-3
• Molecular Formula: C8H12O
• Molecular Weight: 124.183
• DSSTox Substance ID: DTXSID50556406
• Mol file: 13855-29-3.mol

Synonyms:6,6-Dimethylbicyclo[3.1.0]hexan-3-one;13855-29-3;Bicyclo[3.1.0]hexan-3-one, 6,6-dimethyl-;SCHEMBL17048771;DTXSID50556406;MFCD24692453;AKOS023400574;SB46324;AS-64571;EN300-1608517

Chemical Property of 6,6-Dimethylbicyclo[3.1.0]hexan-3-one

Chemical Property:

• Melting Point: 69-70 °C
• Boiling Point: 69-70 °C(Press: 11 Torr)
• PSA: 17.07000
• Density: 0.9591 g/cm3
• LogP: 1.62150
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 124.088815002
• Heavy Atom Count: 9
• Complexity: 153

Purity/Quality:

98%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2C1CC(=O)C2)C

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