1-Octyn-3-ol, 3,6-dimethyl-

Base Information

• Chemical Name: 1-Octyn-3-ol, 3,6-dimethyl-
• CAS No.: 81708-87-4
• Molecular Formula: C10H18 O
• Molecular Weight: 154.25
• European Community (EC) Number: 617-253-3
• DSSTox Substance ID: DTXSID60868623
• Nikkaji Number: J1.587.721I
• Mol file: 81708-87-4.mol

Synonyms:1-Octyn-3-ol, 3,6-dimethyl-;81708-87-4;3,6-Dimethyl-1-octyn-3-ol;1-Octyn-3-ol,3,6-dimethyl-;3,6-Dimethyl-oct-1-yn-3ol;3,6-Dimethyl-1-octyne-3-ol;3,6-dimethyl-oct-1-yn-3-ol;SCHEMBL11129394;DTXSID60868623

Chemical Property of 1-Octyn-3-ol, 3,6-dimethyl-

Chemical Property:

• Vapor Pressure: 0.211mmHg at 25°C
• Boiling Point: 184.3°C at 760 mmHg
• Flash Point: 65.9°C
• PSA: 20.23000
• Density: 0.879g/cm³
• LogP: 2.19690
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 154.135765193
• Heavy Atom Count: 11
• Complexity: 154

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)CCC(C)(C#C)O

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