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Key Documents

W240001

Sigma-Aldrich

γ-Dodecalactone

≥97%, FCC, FG

Synonym(s):

(±)-4-Dodecanolide, (±)-γ-Octyl-γ-butyrolactone, (±)-Dihydro-5-octyl-2(3H)-furanone

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About This Item

Empirical Formula (Hill Notation):
C12H22O2
CAS Number:
Molecular Weight:
198.30
FEMA Number:
2400
Beilstein/REAXYS Number:
126680
EC Number:
Council of Europe no.:
2240
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
10.019
NACRES:
NA.21

biological source

synthetic

Quality Level

grade

FG
Halal
Kosher

reg. compliance

EU Regulation 1334/2008 & 178/2002
FCC
FDA 21 CFR 117

assay

≥97%

refractive index

n20/D 1.452 (lit.)

bp

130-132 °C/1.5 mmHg (lit.)

mp

17-18 °C (lit.)

density

0.936 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

coconut; creamy; fatty; fruity; peach; sweet

SMILES string

CCCCCCCCC1CCC(=O)O1

InChI

1S/C12H22O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h11H,2-10H2,1H3

InChI key

WGPCZPLRVAWXPW-UHFFFAOYSA-N

Gene Information

human ... CYP1A2(1544)

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Application


  • Differentiation of Rums Produced from Sugar Cane Juice (Rhum Agricole) from Rums Manufactured from Sugar Cane Molasses by a Metabolomics Approach.: This study uses a metabolomics approach to differentiate between rums made from sugar cane juice and those from molasses, focusing on key flavor compounds such as gamma-dodecalactone. This research provides insight into the flavor chemistry of rum, supporting better understanding of food flavor and authenticity (Franitza et al., 2018).

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk_germany

WGK 2

flash_point_f

228.2 °F - closed cup

flash_point_c

109 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


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Laura E Korhonen et al.
Journal of medicinal chemistry, 48(11), 3808-3815 (2005-05-27)
The purpose of this study was to determine the cytochrome P450 1A2 (CYP1A2) inhibition potencies of structurally diverse compounds to create a comprehensive three-dimensional quantitative structure-activity relationship (3D-QSAR) model of CYP1A2 inhibitors and to use this model to predict the

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