Tributyl aconitate

CAS Registry Number®

7568-58-3
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CAS Name

Tributyl aconitate

Molecular Formula

C18H30O6

Molecular Mass

342.43

Cite this Page

Tributyl aconitate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7568-58-3 (retrieved 2024-09-20) (CAS RN: 7568-58-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    121 °C @ Press: 2 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H30O6/c1-4-7-10-22-16(19)13-15(18(21)24-12-9-6-3)14-17(20)23-11-8-5-2/h13H,4-12,14H2,1-3H3

InChIKey

InChIKey=BANLNYYTSYHBAP-UHFFFAOYSA-N

SMILES

C(CC(OCCCC)=O)(=CC(OCCCC)=O)C(OCCCC)=O

Canonical SMILES

O=C(OCCCC)C=C(C(=O)OCCCC)CC(=O)OCCCC

Other Names for this Substance

  • 1-Propene-1,2,3-tricarboxylic acid, 1,2,3-tributyl ester
  • 1-Propene-1,2,3-tricarboxylic acid, tributyl ester
  • Aconitic acid, tributyl ester
  • Tributyl aconitate
  • NSC 3922