3-(2-Butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Base Information

• Chemical Name: 3-(2-Butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
• CAS No.: 6917-45-9
• Molecular Formula: C14H22 O5 S
• Molecular Weight: 302.3865
• NSC Number: 202749
• DSSTox Substance ID: DTXSID60308231

Synonyms:6917-45-9;NSC202749;DTXSID60308231;NSC-202749;3-(2-butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Chemical Property of 3-(2-Butylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 6.45E-10mmHg at 25°C
• Boiling Point: 464.5°Cat760mmHg
• Flash Point: 234.8°C
• Density: 1.246g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 302.11879497
• Heavy Atom Count: 20
• Complexity: 360

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCSCCOC(=O)C1C2CCC(C1C(=O)O)O2

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