3,7-Dimethyloctyl isovalerate

Base Information

• Chemical Name: 3,7-Dimethyloctyl isovalerate
• CAS No.: 71662-26-5
• Molecular Formula: C15H30 O2
• Molecular Weight: 242.3975
• European Community (EC) Number: 275-792-6
• DSSTox Substance ID: DTXSID90992248
• Nikkaji Number: J299.008C
• Mol file: 71662-26-5.mol

Synonyms:3,7-Dimethyloctyl isovalerate;71662-26-5;EINECS 275-792-6;3,7-dimethyloctyl 3-methylbutanoate;DTXSID90992248;3-Methylbutanoic acid 3,7-dimethyloctyl ester

Chemical Property of 3,7-Dimethyloctyl isovalerate

Chemical Property:

• Vapor Pressure: 0.01mmHg at 25°C
• Boiling Point: 263.9°C at 760 mmHg
• Flash Point: 117.4°C
• PSA: 26.30000
• Density: 0.863g/cm³
• LogP: 4.42820
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 242.224580195
• Heavy Atom Count: 17
• Complexity: 197

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)CCCC(C)CCOC(=O)CC(C)C

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