1-(2,4-Bis(isopropyl)phenyl)butane-1,3-dione

Base Information

• Chemical Name: 1-(2,4-Bis(isopropyl)phenyl)butane-1,3-dione
• CAS No.: 59863-33-1
• Molecular Formula: C16H22 O2
• Molecular Weight: 246.34468
• European Community (EC) Number: 261-960-6
• DSSTox Substance ID: DTXSID50208579
• Nikkaji Number: J298.246C
• Wikidata: Q83082676
• Mol file: 59863-33-1.mol

Synonyms:59863-33-1;1-(2,4-Bis(isopropyl)phenyl)butane-1,3-dione;1-[2,4-di(propan-2-yl)phenyl]butane-1,3-dione;EINECS 261-960-6;1-[2,4-BIS(ISOPROPYL)PHENYL]BUTANE-1,3-DIONE;1-[2,4-bis(propan-2-yl)phenyl]butane-1,3-dione;DTXSID50208579;1-[2,4-bis-(Isopropyl)phenyl]butane-1,3-dione;1-[2,4-Bis(1-methylethyl)phenyl]-1,3-butanedione

Chemical Property of 1-(2,4-Bis(isopropyl)phenyl)butane-1,3-dione

Chemical Property:

• Vapor Pressure: 2.53E-05mmHg at 25°C
• Boiling Point: 358.5°C at 760 mmHg
• Flash Point: 134.5°C
• PSA: 34.14000
• Density: 0.98g/cm³
• LogP: 4.09520
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 246.161979940
• Heavy Atom Count: 18
• Complexity: 304

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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