Methyl-2-butylmercapto-4-catechol

Base Information

• Chemical Name: Methyl-2-butylmercapto-4-catechol
• CAS No.: 100469-46-3
• Molecular Formula: C11H16O2S
• Molecular Weight: 212.30854
• DSSTox Substance ID: DTXSID10905517
• Nikkaji Number: J488.767K
• Mol file: 100469-46-3.mol

Synonyms:EP 10045;EP-10045;methyl-2-butylmercapto-4-catechol

Chemical Property of Methyl-2-butylmercapto-4-catechol

Chemical Property:

• Vapor Pressure: 1.59E-05mmHg at 25°C
• Boiling Point: 354.9°C at 760 mmHg
• Flash Point: 172.6°C
• PSA: 65.76000
• Density: 1.17g/cm³
• LogP: 3.23600
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 212.08710092
• Heavy Atom Count: 14
• Complexity: 163

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)CSC1=CC(=C(C=C1)O)O