(3R)-6-Oxo-3-(propan-2-yl)heptanal

Base Information

• Chemical Name: (3R)-6-Oxo-3-(propan-2-yl)heptanal
• CAS No.: 67304-08-9
• Molecular Formula: C₁₀H₁₈O₂
• Molecular Weight: 170.252
• DSSTox Substance ID: DTXSID20505143
• Nikkaji Number: J72.061E
• Mol file: 67304-08-9.mol

Synonyms:(3R)-6-Oxo-3-(propan-2-yl)heptanal;67304-08-9;SCHEMBL10412363;DTXSID20505143

Chemical Property of (3R)-6-Oxo-3-(propan-2-yl)heptanal

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 170.130679813
• Heavy Atom Count: 12
• Complexity: 150

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)C(CCC(=O)C)CC=O
• Isomeric SMILES: CC(C)[C@H](CCC(=O)C)CC=O