1-Cycloocten-5-yne

Base Information

• Chemical Name: 1-Cycloocten-5-yne
• CAS No.: 68177-00-4
• Molecular Formula: C8H10
• Molecular Weight: 106.165
• Nikkaji Number: J144.615K,J2.964.175G
• Mol file: 68177-00-4.mol

Synonyms:1-Cycloocten-5-yne;1-Cycloocten-5-yne, (Z)-;68177-00-4;cycloocten-5-yne;1-Cyclooctene-5-yne;1-Cycloocten-5-yne #;(Z)-1-Cycloocten-5-yne;Cyclooct-(1Z)-en-5-yne;TZIKXLXKOIRQBI-UPHRSURJSA-N;66633-23-6

Chemical Property of 1-Cycloocten-5-yne

Chemical Property:

• Vapor Pressure: 4.19mmHg at 25°C
• Boiling Point: 153.9°Cat760mmHg
• Flash Point: 33.4°C
• PSA: 0.00000
• Density: 0.89g/cm³
• LogP: 2.12000
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 106.078250319
• Heavy Atom Count: 8
• Complexity: 126

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC#CCCC=C1
• Isomeric SMILES: C/1CC#CCC/C=C1