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octan-3-yl 2-sulfanylpropanoate

octan-3-yl 2-sulfanylpropanoate

Systemtic Name:octan-3-yl 2-sulfanylpropanoate
Openeye Name:1-ethylhexyl 2-sulfanylpropanoate
CAS Name:2-mercaptopropanoic acid octan-3-yl ester
IUPAC Name:octan-3-yl 2-sulfanylpropanoate
Traditional Name:2-mercaptopropionic acid 1-ethylhexyl ester
Formula: C11H22O2S
MolecularWeight: 218.35618
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C(C)S


Isomeric SMILES

CCCCCC(CC)OC(=O)C(C)S


InChI

InChI=1S/C11H22O2S/c1-4-6-7-8-10(5-2)13-11(12)9(3)14/h9-10,14H,4-8H2,1-3H3


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