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3,4-bis(2-methylhexyl)phthalate

3,4-bis(2-methylhexyl)phthalate

Systemtic Name:3,4-bis(2-methylhexyl)phthalate
Openeye Name:3,4-bis(2-methylhexyl)phthalate
CAS Name:3,4-bis(2-methylhexyl)phthalate
IUPAC Name:3,4-bis(2-methylhexyl)phthalate
Traditional Name:3,4-bis(2-methylhexyl)phthalate
Formula: C22H32O4-2
MolecularWeight: 360.48708
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC(C)CCCC


Isomeric SMILES

CCCCC(C)CC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC(C)CCCC


InChI

InChI=1S/C22H34O4/c1-5-7-9-15(3)13-17-11-12-18(21(23)24)20(22(25)26)19(17)14-16(4)10-8-6-2/h11-12,15-16H,5-10,13-14H2,1-4H3,(H,23,24)(H,25,26)/p-2


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