3-Ethylpentane-1,3-diol

Base Information

• Chemical Name: 3-Ethylpentane-1,3-diol
• CAS No.: 79388-50-4
• Molecular Formula: C₇H₁₆O₂
• Molecular Weight: 132.203
• DSSTox Substance ID: DTXSID10507611
• Wikidata: Q82363912
• Mol file: 79388-50-4.mol

Synonyms:3-ETHYLPENTANE-1,3-DIOL;79388-50-4;1,3-Pentanediol, 3-ethyl-;SCHEMBL1674824;DTXSID10507611;AKOS006328166;FT-0646561;A839669

Chemical Property of 3-Ethylpentane-1,3-diol

Chemical Property:

• Vapor Pressure: 0.018mmHg at 25°C
• Refractive Index: 1.452
• Boiling Point: 224.839 °C at 760 mmHg
• Flash Point: 100.53 °C
• PSA: 40.46000
• Density: 0.95 g/cm³
• LogP: 0.91990
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 132.115029749
• Heavy Atom Count: 9
• Complexity: 67.3

Purity/Quality:

97% ^*data from raw suppliers

3-ETHYLPENTANE-1,3-DIOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)(CCO)O

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