Diisobutyl phthalate

CAS Registry Number®

84-69-5

CAS Name

Diisobutyl phthalate

Molecular Formula

C16H22O4

Molecular Mass

278.34

Cite this Page

Diisobutyl phthalate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=84-69-5 (retrieved 2024-11-24) (CAS RN: 84-69-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    296.5 °C

  • Melting Point (1)

    -64 °C

  • Density (1)

    1.039 g/cm³ @ Temp: 20 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C16H22O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3

InChIKey

InChIKey=MGWAVDBGNNKXQV-UHFFFAOYSA-N

SMILES

C(OCC(C)C)(=O)C1=C(C(OCC(C)C)=O)C=CC=C1

Canonical SMILES

O=C(OCC(C)C)C=1C=CC=CC1C(=O)OCC(C)C

Other Names for this Substance

  • 1,2-Benzenedicarboxylic acid, 1,2-bis(2-methylpropyl) ester
  • Phthalic acid, diisobutyl ester
  • 1,2-Benzenedicarboxylic acid, bis(2-methylpropyl) ester
  • Diisobutyl phthalate
  • Hexaplas M/1B

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