2,6-Dimethyl-4-(2-(2-thienyl)ethenyl)phenol

Base Information

• Chemical Name: 2,6-Dimethyl-4-(2-(2-thienyl)ethenyl)phenol
• CAS No.: 125721-82-6
• Molecular Formula: C14H14 O S
• Molecular Weight: 230.33
• Nikkaji Number: J545.178G,J328.568E
• Pharos Ligand ID: F7QDM1XJ8M1U
• ChEMBL ID: CHEMBL56798
• Mol file: 125721-82-6.mol

Synonyms:2,6-dimethyl-4-(2-(2-thienyl)ethenyl)phenol;BI-L 226;BI-L-226

Chemical Property of 2,6-Dimethyl-4-(2-(2-thienyl)ethenyl)phenol

Chemical Property:

• Vapor Pressure: 1.09E-05mmHg at 25°C
• Boiling Point: 360.2°C at 760 mmHg
• Flash Point: 171.6°C
• PSA: 48.47000
• Density: 1.192g/cm³
• LogP: 4.24090
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 230.07653624
• Heavy Atom Count: 16
• Complexity: 239

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1O)C)C=CC2=CC=CS2
• Isomeric SMILES: CC1=CC(=CC(=C1O)C)/C=C/C2=CC=CS2