Isobutyl 3-thienylacetate

Base Information

• Chemical Name: Isobutyl 3-thienylacetate
• CAS No.: 94023-53-7
• Molecular Formula: C10H14 O2 S
• Molecular Weight: 198.28196
• European Community (EC) Number: 301-651-6
• DSSTox Substance ID: DTXSID10240314
• Nikkaji Number: J348.996E
• Wikidata: Q83123112
• Mol file: 94023-53-7.mol

Synonyms:Isobutyl 3-thienylacetate;94023-53-7;EINECS 301-651-6;DTXSID10240314;3-Thiopheneacetic acid isobutyl ester

Chemical Property of Isobutyl 3-thienylacetate

Chemical Property:

• Vapor Pressure: 0.0127mmHg at 25°C
• Boiling Point: 259.7°Cat760mmHg
• Flash Point: 110.9°C
• PSA: 54.54000
• Density: 1.091g/cm³
• LogP: 2.48980
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 198.07145086
• Heavy Atom Count: 13
• Complexity: 168

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)COC(=O)CC1=CSC=C1