3-Methoxy-3-oxo-2-(thiophen-2-ylmethyl)propanoate

Base Information

• Chemical Name: 3-Methoxy-3-oxo-2-(thiophen-2-ylmethyl)propanoate
• CAS No.: 122308-24-1
• Molecular Formula: C9H10O4S
• Molecular Weight: 214.2383
• DSSTox Substance ID: DTXSID90600139
• Mol file: 122308-24-1.mol

Synonyms:Propanedioic acid, 2-(2-thienylmethyl)-, 1-methyl ester;3-METHOXY-3-OXO-2-(THIOPHEN-2-YLMETHYL)PROPANOATE;DTXSID90600139;monomethyl 2-thienylmethylmalonate;RXXLAMKEUHLEAN-UHFFFAOYSA-M;3-Methoxy-3-oxo-2-[(thiophen-2-yl)methyl]propanoate

Chemical Property of 3-Methoxy-3-oxo-2-(thiophen-2-ylmethyl)propanoate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.556
• Boiling Point: 350.383 °C at 760 mmHg
• Flash Point: 165.706 °C
• PSA: 91.84000
• Density: 1.341 g/cm³
• LogP: 1.16440
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 213.02215494
• Heavy Atom Count: 14
• Complexity: 223

Purity/Quality:

98%Min ^*data from raw suppliers

3-Methoxy-3-oxo-2-(thiophen-2-ylmethyl)propanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C(CC1=CC=CS1)C(=O)[O-]