1,6-Bis(3-methylbutyl) hexanedioate

CAS Registry Number®

6624-70-0
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CAS Name

1,6-Bis(3-methylbutyl) hexanedioate

Molecular Formula

C16H30O4

Molecular Mass

286.41

Cite this Page

1,6-Bis(3-methylbutyl) hexanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6624-70-0 (retrieved 2024-04-26) (CAS RN: 6624-70-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    190 °C @ Press: 15 Torr

  • Density (1)

    0.9455 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H30O4/c1-13(2)9-11-19-15(17)7-5-6-8-16(18)20-12-10-14(3)4/h13-14H,5-12H2,1-4H3

InChIKey

InChIKey=HIEOGLNFUKBFCF-UHFFFAOYSA-N

SMILES

O(C(CCCCC(OCCC(C)C)=O)=O)CCC(C)C

Canonical SMILES

O=C(OCCC(C)C)CCCCC(=O)OCCC(C)C

Other Names for this Substance

  • Hexanedioic acid, 1,6-bis(3-methylbutyl) ester
  • Adipic acid, diisopentyl ester
  • Hexanedioic acid, bis(3-methylbutyl) ester
  • Isopentyl alcohol, adipate (2:1)
  • 1,6-Bis(3-methylbutyl) hexanedioate

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