(1S,7S,9R,10S)-1,9-Dimethyl-4-methylidene-6,13-dioxatricyclo[8.4.0.03,7]tetradecane-5,12-dione

Base Information

• Chemical Name: (1S,7S,9R,10S)-1,9-Dimethyl-4-methylidene-6,13-dioxatricyclo[8.4.0.03,7]tetradecane-5,12-dione
• CAS No.: 16983-23-6
• Molecular Formula: C15H20 O4
• Molecular Weight: 264.32
• NSC Number: 136718
• Metabolomics Workbench ID: 125902
• ChEMBL ID: CHEMBL1975417
• Mol file: 16983-23-6.mol

Synonyms:(1S,7S,9R,10S)-1,9-Dimethyl-4-methylidene-6,13-dioxatricyclo[8.4.0.03,7]tetradecane-5,12-dione;NSC-136718;CHEMBL1975417;NSC136718;Furo[2',6]cycloheepta[1,2-c]pyran-2,7(3H,4H)-dione, 3a,4a,5,8,8a.alpha.,9,10a.beta.-octahydro-4a.beta.,9.alpha.-dimethyl-3-methylene-

Chemical Property of (1S,7S,9R,10S)-1,9-Dimethyl-4-methylidene-6,13-dioxatricyclo[8.4.0.03,7]tetradecane-5,12-dione

Chemical Property:

• Vapor Pressure: 1.08E-08mmHg at 25°C
• Boiling Point: 461.4°Cat760mmHg
• Flash Point: 239.2°C
• PSA: 52.60000
• Density: 1.17g/cm³
• LogP: 2.08350
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 264.13615911
• Heavy Atom Count: 19
• Complexity: 455

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1CC2C(CC3(C1CC(=O)OC3)C)C(=C)C(=O)O2
• Isomeric SMILES: C[C@@H]1C[C@H]2C(C[C@]3([C@H]1CC(=O)OC3)C)C(=C)C(=O)O2