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3,4-dihexadecylphthalate

3,4-dihexadecylphthalate

Systemtic Name:3,4-dihexadecylphthalate
Openeye Name:3,4-dihexadecylphthalate
CAS Name:3,4-dihexadecylphthalate
IUPAC Name:3,4-dihexadecylphthalate
Traditional Name:3,4-dicetylphthalate
Formula: C40H68O4-2
MolecularWeight: 612.96552
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCCCCCCCCCCCCCC


InChI

InChI=1S/C40H70O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-33-34-37(39(41)42)38(40(43)44)36(35)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34H,3-32H2,1-2H3,(H,41,42)(H,43,44)/p-2


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