AC1L77EQ structure

AC1L77EQ

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

Also Known As: 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan|3-{[2-(Methylsulfanyl)ethoxy]carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid|3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid|6-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-5-carboxylic acid

CAS: 6915-71-5
Molecular Formula C11H16O5S
Molecular Weight 260.07184 g/mol
LogP 0.5
Topological Polar Surface Area 98.1 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 260.07184
Monoisotopic Mass 260.07184
Heavy Atoms 17
Complexity 319.0

Chemical Identifiers

CAS Number 6915-71-5
SMILES CSCCOC(=O)C1C2CCC(C1C(=O)O)O2
InChIKey RNBITUPTTPEOLD-UHFFFAOYSA-N

Product Overview

AC1L77EQ (CAS 6915-71-5), with molecular formula C11H16O5S and molecular weight 260.07184 g/mol. IUPAC: 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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