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3,4,5-trihexylphthalic acid

3,4,5-trihexylphthalic acid

Systemtic Name:3,4,5-trihexylphthalic acid
Openeye Name:3,4,5-trihexylphthalic acid
CAS Name:3,4,5-trihexylphthalic acid
IUPAC Name:3,4,5-trihexylphthalic acid
Traditional Name:3,4,5-trihexylphthalic acid
Formula: C26H42O4
MolecularWeight: 418.60928
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C(=C1)C(=O)O)C(=O)O)CCCCCC)CCCCCC


Isomeric SMILES

CCCCCCC1=C(C(=C(C(=C1)C(=O)O)C(=O)O)CCCCCC)CCCCCC


InChI

InChI=1S/C26H42O4/c1-4-7-10-13-16-20-19-23(25(27)28)24(26(29)30)22(18-15-12-9-6-3)21(20)17-14-11-8-5-2/h19H,4-18H2,1-3H3,(H,27,28)(H,29,30)


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