6-({2-[(3-Oxoprop-1-en-2-yl)oxy]ethoxy}carbonyl)cyclohex-3-ene-1-carboxylic acid

Base Information

• Chemical Name: 6-({2-[(3-Oxoprop-1-en-2-yl)oxy]ethoxy}carbonyl)cyclohex-3-ene-1-carboxylic acid
• CAS No.: 70559-03-4
• Molecular Formula: C13H16O6
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID60703520
• Mol file: 70559-03-4.mol

Synonyms:70559-03-4;DTXSID60703520;6-({2-[(3-Oxoprop-1-en-2-yl)oxy]ethoxy}carbonyl)cyclohex-3-ene-1-carboxylic acid

Chemical Property of 6-({2-[(3-Oxoprop-1-en-2-yl)oxy]ethoxy}carbonyl)cyclohex-3-ene-1-carboxylic acid

Chemical Property:

• PSA: 89.90000
• LogP: 0.92580
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 268.09468823
• Heavy Atom Count: 19
• Complexity: 398

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C(C=O)OCCOC(=O)C1CC=CCC1C(=O)O