3-Methyl-6-methyleneoct-4-yn-3-ol

Base Information

• Chemical Name: 3-Methyl-6-methyleneoct-4-yn-3-ol
• CAS No.: 40454-29-3
• Molecular Formula: C10H16 O
• Molecular Weight: 152.23344
• European Community (EC) Number: 254-926-7
• DSSTox Substance ID: DTXSID70885801
• Nikkaji Number: J332.425G
• Mol file: 40454-29-3.mol

Synonyms:3-Methyl-6-methyleneoct-4-yn-3-ol;40454-29-3;3-Methyl-6-methylene-4-octyn-3-ol;4-Octyn-3-ol, 3-methyl-6-methylene-;EINECS 254-926-7;DTXSID70885801

Chemical Property of 3-Methyl-6-methyleneoct-4-yn-3-ol

Chemical Property:

• Vapor Pressure: 0.0247mmHg at 25°C
• Boiling Point: 219.7°C at 760 mmHg
• Flash Point: 90.8°C
• PSA: 20.23000
• Density: 0.898g/cm³
• LogP: 2.11700
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 152.120115130
• Heavy Atom Count: 11
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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