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2-ethylhexanoic acid

2-ethylhexanoic acid

Systemtic Name:2-ethylhexanoic acid
Openeye Name:2-ethylhexanoic acid
CAS Name:2-ethylhexanoic acid
IUPAC Name:2-ethylhexanoic acid
Traditional Name:2-ethylhexanoic acid
Formula: C48H96O12
MolecularWeight: 865.26864
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O


Isomeric SMILES

CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O


InChI

InChI=1S/6C8H16O2/c6*1-3-5-6-7(4-2)8(9)10/h6*7H,3-6H2,1-2H3,(H,9,10)


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