2-[(E)-non-1-en-3,5,7-triynyl]oxan-3-ol

Base Information

• Chemical Name: 2-[(E)-non-1-en-3,5,7-triynyl]oxan-3-ol
• CAS No.: 20110-23-0
• Molecular Formula: C14H14 O2
• Molecular Weight: 214.26
• Wikidata: Q27116202
• Mol file: 20110-23-0.mol

Synonyms:ichthyothereol;ichthyothereol acetate;ichthyothereol acetate, (2alpha(E),3beta)-isomer;ichthyothereol acetate, (2S-(2alpha(E),3beta))-isomer;ichthyothereol, (2alpha(E),3beta)-isomer;ichthyothereol, (2S-(2alpha(E),3beta))-isomer

Chemical Property of 2-[(E)-non-1-en-3,5,7-triynyl]oxan-3-ol

Chemical Property:

• Vapor Pressure: 4.31E-06mmHg at 25°C
• Boiling Point: 344.1°Cat760mmHg
• Flash Point: 148.4°C
• PSA: 29.46000
• Density: 1.194g/cm³
• LogP: 1.11260
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 214.099379685
• Heavy Atom Count: 16
• Complexity: 446

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC#CC#CC#CC=CC1C(CCCO1)O
• Isomeric SMILES: CC#CC#CC#C/C=C/C1C(CCCO1)O