[6-(7-Oxabicyclo[4.1.0]heptan-3-ylmethoxy)-6-oxohexyl] 7-oxabicyclo[4.1.0]heptane-3-carboxylate

Base Information

• Chemical Name: [6-(7-Oxabicyclo[4.1.0]heptan-3-ylmethoxy)-6-oxohexyl] 7-oxabicyclo[4.1.0]heptane-3-carboxylate
• CAS No.: 139198-19-9
• Molecular Formula: C21H32O5
• Molecular Weight: 0
• European Community (EC) Number: 696-039-1
• DSSTox Substance ID: DTXSID901105577
• Nikkaji Number: J1.799.400J
• Mol file: 139198-19-9.mol

Synonyms:139198-19-9;SCHEMBL681607;CMWJQPSNGFJMNX-UHFFFAOYSA-N;DTXSID901105577

Chemical Property of [6-(7-Oxabicyclo[4.1.0]heptan-3-ylmethoxy)-6-oxohexyl] 7-oxabicyclo[4.1.0]heptane-3-carboxylate

Chemical Property:

• PSA: 65.13000
• LogP: 3.63690
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 366.20423867
• Heavy Atom Count: 26
• Complexity: 520

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC2C(O2)CC1COC(=O)CCCCCOC(=O)C3CCC4C(C3)O4