1-Octyl 6-(phenylmethyl) hexanedioate

CAS Registry Number®

3089-55-2
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CAS Name

1-Octyl 6-(phenylmethyl) hexanedioate

Molecular Formula

C21H32O4

Molecular Mass

348.48

Cite this Page

1-Octyl 6-(phenylmethyl) hexanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=3089-55-2 (retrieved 2024-04-20) (CAS RN: 3089-55-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H32O4/c1-2-3-4-5-6-12-17-24-20(22)15-10-11-16-21(23)25-18-19-13-8-7-9-14-19/h7-9,13-14H,2-6,10-12,15-18H2,1H3

InChIKey

InChIKey=DECACTMEFWAFRE-UHFFFAOYSA-N

SMILES

C(OC(CCCCC(OCCCCCCCC)=O)=O)C1=CC=CC=C1

Canonical SMILES

O=C(OCC=1C=CC=CC1)CCCCC(=O)OCCCCCCCC

Other Names for this Substance

  • Hexanedioic acid, 1-octyl 6-(phenylmethyl) ester
  • Adipic acid, benzyl octyl ester
  • Hexanedioic acid, octyl phenylmethyl ester
  • 1-Octyl 6-(phenylmethyl) hexanedioate
  • Benzyl octyl adipate

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