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Merck
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Key Documents

193321

Sigma-Aldrich

Piperonyl isobutyrate

99%

Synonym(s):

Isobutyric acid 3,4-methylenedioxybenzyl ester

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About This Item

Empirical Formula (Hill Notation):
C12H14O4
CAS Number:
Molecular Weight:
222.24
MDL number:

Assay

99%

refractive index

n20/D 1.511 (lit.)

bp

91-92 °C/0.005 mmHg (lit.)

density

1.154 g/mL at 25 °C (lit.)

SMILES string

CC(C)C(=O)OCc1ccc2OCOc2c1

InChI

1S/C12H14O4/c1-8(2)12(13)14-6-9-3-4-10-11(5-9)16-7-15-10/h3-5,8H,6-7H2,1-2H3

InChI key

RQULTIASPCVEFO-UHFFFAOYSA-N

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