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sodium 2-butyloctanoate

sodium 2-butyloctanoate

Systemtic Name:sodium 2-butyloctanoate
Openeye Name:sodium 2-butyloctanoate
CAS Name:sodium 2-butyloctanoate
IUPAC Name:sodium 2-butyloctanoate
Traditional Name:sodium 2-butylcaprylate
Formula: C12H23NaO2
MolecularWeight: 222.29959
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCC)C(=O)[O-].[Na+]


Isomeric SMILES

CCCCCCC(CCCC)C(=O)[O-].[Na+]


InChI

InChI=1S/C12H24O2.Na/c1-3-5-7-8-10-11(12(13)14)9-6-4-2;/h11H,3-10H2,1-2H3,(H,13,14);/q;+1/p-1


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