3-(Benzoyloxy)-2,2,4-trimethylpentyl 2-methylpropanoate

CAS Registry Number®

22527-63-5
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CAS Name

3-(Benzoyloxy)-2,2,4-trimethylpentyl 2-methylpropanoate

Molecular Formula

C19H28O4

Molecular Mass

320.42

Cite this Page

3-(Benzoyloxy)-2,2,4-trimethylpentyl 2-methylpropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22527-63-5 (retrieved 2024-05-16) (CAS RN: 22527-63-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H28O4/c1-13(2)16(19(5,6)12-22-17(20)14(3)4)23-18(21)15-10-8-7-9-11-15/h7-11,13-14,16H,12H2,1-6H3

InChIKey

InChIKey=FFSJSGNXYKUSCQ-UHFFFAOYSA-N

SMILES

C(OC(=O)C1=CC=CC=C1)(C(COC(C(C)C)=O)(C)C)C(C)C

Canonical SMILES

O=C(OC(C(C)C)C(C)(C)COC(=O)C(C)C)C=1C=CC=CC1

Other Names for this Substance

  • Propanoic acid, 2-methyl-, 3-(benzoyloxy)-2,2,4-trimethylpentyl ester
  • Isobutyric acid, 3-hydroxy-2,2,4-trimethylpentyl ester benzoate
  • 3-(Benzoyloxy)-2,2,4-trimethylpentyl 2-methylpropanoate
  • 3-Benzoyloxy-2,2,4-trimethylpentyl isobutyrate

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