(1S,5R)-6,6-Dimethyl-3-oxabicyclo[3.1.0]hexan-2-one

Base Information

• Chemical Name: (1S,5R)-6,6-Dimethyl-3-oxabicyclo[3.1.0]hexan-2-one
• CAS No.: 82442-72-6
• Molecular Formula: C7H10O2
• Molecular Weight: 126.155
• DSSTox Substance ID: DTXSID20452426
• Nikkaji Number: J679.156E
• Wikidata: Q82273056
• Mol file: 82442-72-6.mol

Synonyms:82442-72-6;(1S,5R)-6,6-Dimethyl-3-oxabicyclo[3.1.0]hexan-2-one;rac-(1r,5s)-6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-2-one;(1R, 5S)-6,6-dimethyl-3-oxabicyclo [3.1.0] hexan-2-one;SCHEMBL5835979;DTXSID20452426;EN300-26862927

Chemical Property of (1S,5R)-6,6-Dimethyl-3-oxabicyclo[3.1.0]hexan-2-one

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 126.068079557
• Heavy Atom Count: 9
• Complexity: 172

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(C2C1C(=O)OC2)C
• Isomeric SMILES: CC1([C@H]2[C@@H]1C(=O)OC2)C