4,5-Diisopropylfurfural

Base Information

• Chemical Name: 4,5-Diisopropylfurfural
• CAS No.: 33554-12-0
• Molecular Formula: C₁₁H₁₆O₂
• Molecular Weight: 180.247
• DSSTox Substance ID: DTXSID301258403

Synonyms:4,5-diisopropylfurfural;33554-12-0;4,5-diisopropyl-furfural;SCHEMBL2406497;MNSFLUSWSAAOHD-UHFFFAOYSA-N;DTXSID301258403;4,5-Bis(1-methylethyl)-2-furancarboxaldehyde

Chemical Property of 4,5-Diisopropylfurfural

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 180.115029749
• Heavy Atom Count: 13
• Complexity: 175

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)C1=C(OC(=C1)C=O)C(C)C

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