decanoic acid; hexanoic acid; 6-methylheptanoic acid; octanoic acid; phthalic acid

Systemtic Name: decanoic acid; hexanoic acid; 6-methylheptanoic acid; octanoic acid; phthalic acid Openeye Name: decanoic acid; hexanoic acid; 6-methylheptanoic acid; octanoic acid; phthalic acid CAS Name: decanoic acid; hexanoic acid; 6-methylheptanoic acid; octanoic acid; phthalic acid IUPAC Name: decanoic acid; hexanoic acid; 6-methylheptanoic acid; octanoic acid; phthalic acid Traditional Name: capric acid; caprylic acid; hexanoic acid; 6-methylenanthic acid; phthalic acid Formula: C40H70O12 MolecularWeight: 742.9766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCC(=O)O.CC(C)CCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCC(=O)O.CC(C)CCCCC(=O)O.C1=CC=C(C(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C10H20O2.C8H6O4.2C8H16O2.C6H12O2/c1-2-3-4-5-6-7-8-9-10(11)12;9-7(10)5-3-1-2-4-6(5)8(11)12;1-7(2)5-3-4-6-8(9)10;1-2-3-4-5-6-7-8(9)10;1-2-3-4-5-6(7)8/h2-9H2,1H3,(H,11,12);1-4H,(H,9,10)(H,11,12);7H,3-6H2,1-2H3,(H,9,10);2-7H2,1H3,(H,9,10);2-5H2,1H3,(H,7,8)