2-(1-Ethylpentyl)-1,3-dioxan-5-ol

Base Information

• Chemical Name: 2-(1-Ethylpentyl)-1,3-dioxan-5-ol
• CAS No.: 4969-00-0
• Molecular Formula: C11H22O3
• Molecular Weight: 202.2906
• European Community (EC) Number: 225-609-0
• NSC Number: 406722
• DSSTox Substance ID: DTXSID90964344
• Nikkaji Number: J203.210D
• Mol file: 4969-00-0.mol

Synonyms:4969-00-0;2-(1-Ethylpentyl)-1,3-dioxan-5-ol;EINECS 225-609-0;2-(heptan-3-yl)-1,3-dioxan-5-ol;NSC406722;SCHEMBL10000237;DTXSID90964344;C(CC)(CCCC)C1OCC(O)CO1;NSC 406722;NSC-406722

Chemical Property of 2-(1-Ethylpentyl)-1,3-dioxan-5-ol

Chemical Property:

• Vapor Pressure: 0.00012mmHg at 25°C
• Boiling Point: 299.3°Cat760mmHg
• Flash Point: 134.8°C
• PSA: 38.69000
• Density: 0.993g/cm³
• LogP: 1.93660
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 202.15689456
• Heavy Atom Count: 14
• Complexity: 142

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)C1OCC(CO1)O

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