Diundecyl Phthalate, (mixture of branched chain isomers)

Name: Diundecyl Phthalate, (mixture of branched chain isomers)
SKU: ACM96507867-2
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Catalog NumberACM96507867-2

CAS Number96507-86-7

CategoryPlasticizers

Diundecyl Phthalate, (mixture of branched chain isomers)

IUPAC Name

bis(9-methyldecyl) benzene-1,2-dicarboxylate

Molecular Weight

474.7g/mol

Molecular Formula

C30H50O4

Canonical SMILES

CC(C)CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC(C)C

InChI

InChI=1S/C30H50O4/c1-25(2)19-13-9-5-7-11-17-23-33-29(31)27-21-15-16-22-28(27)30(32)34-24-18-12-8-6-10-14-20-26(3)4/h15-16,21-22,25-26H,5-14,17-20,23-24H2,1-4H3

InChI Key

LGBAGUMSAPUZPU-UHFFFAOYSA-N

Complexity

468

Covalently-Bonded Unit Count

EC Number

306-165-8

Exact Mass

474.37091g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

474.37091g/mol

NSC Number

17081

Rotatable Bond Count

XLogP3

11.7

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