4-Propylheptan-1-ol

Base Information

• Chemical Name: 4-Propylheptan-1-ol
• CAS No.: 2768-17-4
• Molecular Formula: C₁₀H₂₂O
• Molecular Weight: 158.284
• European Community (EC) Number: 608-125-8
• DSSTox Substance ID: DTXSID001315555
• Mol file: 2768-17-4.mol

Synonyms:4-propylheptan-1-ol;2768-17-4;4-propyl-heptan-1-ol;4-Propyl-1-heptanol;Dipropylbutanol [French];Dipropylbutanol;Propyl-4 heptanol;1-Heptanol, 4-propyl-;Propyl-4 heptanol [French];SCHEMBL236338;NIOSH/MJ4800020;DTXSID001315555;AKOS006277664;BS-46207;LS-74459;MJ48000200;E75094;EN300-1868790

Chemical Property of 4-Propylheptan-1-ol

Chemical Property:

• Vapor Pressure: 0.0365mmHg at 25°C
• Boiling Point: 213.4°C at 760 mmHg
• PKA: 15.17±0.10(Predicted)
• Flash Point: 87.1°C
• PSA: 20.23000
• Density: 0.826g/cm³
• LogP: 2.97530
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 158.167065321
• Heavy Atom Count: 11
• Complexity: 65.3

Purity/Quality:

99% ^*data from raw suppliers

4-PROPYL-1-HEPTANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC(CCC)CCCO
• Uses: 4-Propyl-1-heptanol is a useful compound in organic synthesis.

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