Pentanoic acid, 3-(2,2-dimethyl-1-oxo-3-((1-oxopentyl)oxy)propoxy)-2,2-dimethylpropyl ester

Base Information

• Chemical Name: Pentanoic acid, 3-(2,2-dimethyl-1-oxo-3-((1-oxopentyl)oxy)propoxy)-2,2-dimethylpropyl ester
• CAS No.: 71850-74-3
• Molecular Formula: C20H36 O6
• Molecular Weight: 372.5
• DSSTox Substance ID: DTXSID9072442
• Nikkaji Number: J446.983F
• Wikidata: Q82000484
• Mol file: 71850-74-3.mol

Synonyms:71850-74-3;Pentanoic acid, 3-(2,2-dimethyl-1-oxo-3-((1-oxopentyl)oxy)propoxy)-2,2-dimethylpropyl ester;Pentanoic acid, 3-[2,2-dimethyl-1-oxo-3-[(1-oxopentyl)oxy]propoxy]-2,2-dimethylpropyl ester;DTXSID9072442;PENTANOIC ACID 3-[2,2-DIMETHYL-1-OXO-3-[(1-OXOPENTYL)OXY]PROPOXY]-2,2-DIMETHYLPROPYL ESTER

Chemical Property of Pentanoic acid, 3-(2,2-dimethyl-1-oxo-3-((1-oxopentyl)oxy)propoxy)-2,2-dimethylpropyl ester

Chemical Property:

• Vapor Pressure: 8.04E-07mmHg at 25°C
• Boiling Point: 406.6°C at 760 mmHg
• Flash Point: 170.2°C
• PSA: 78.90000
• Density: 1.008g/cm³
• LogP: 4.04880
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 16
• Exact Mass: 372.25118886
• Heavy Atom Count: 26
• Complexity: 453

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(=O)OCC(C)(C)COC(=O)C(C)(C)COC(=O)CCCC

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