Neopentyl glycol dicaprylate

CAS Registry Number®

31335-74-7

CAS Name

Neopentyl glycol dicaprylate

Molecular Formula

C21H40O4

Molecular Mass

356.54

Cite this Page

Neopentyl glycol dicaprylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=31335-74-7 (retrieved 2024-12-22) (CAS RN: 31335-74-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Density (1)

    0.9206 g/cm³ @ Temp: 15 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H40O4/c1-5-7-9-11-13-15-19(22)24-17-21(3,4)18-25-20(23)16-14-12-10-8-6-2/h5-18H2,1-4H3

InChIKey

InChIKey=WFXHUBZUIFLWCV-UHFFFAOYSA-N

SMILES

C(C(COC(CCCCCCC)=O)(C)C)OC(CCCCCCC)=O

Canonical SMILES

O=C(OCC(C)(C)COC(=O)CCCCCCC)CCCCCCC

Other Names for this Substance

  • Octanoic acid, 1,1′-(2,2-dimethyl-1,3-propanediyl) ester
  • Octanoic acid, 2,2-dimethyltrimethylene ester
  • Octanoic acid, 2,2-dimethyl-1,3-propanediyl ester
  • Neopentyl glycol dicaprylate
  • Neopentylglycol dioctanoate

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