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W512508

Sigma-Aldrich

3,7-Dimethyl-2,6-octadienenitrile

mixture of isomers, ≥97%

Linear Formula:
(CH3)2C=CHCH2CH2C(CH3)=CHCN
CAS Number:
Molecular Weight:
149.23
EC Number:
MDL number:
PubChem Substance ID:
Flavis number:
16.05

biological source

synthetic

assay

≥97%

refractive index

n20/D 1.475 (lit.)

bp

110 °C/1.3 mmHg (lit.)

density

0.853 g/mL at 25 °C (lit.)

Featured Industry

Flavors and Fragrances

SMILES string

C\C(C)=C\CC\C(C)=C\C#N

InChI

1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6H2,1-3H3/b10-7+

InChI key

HLCSDJLATUNSSI-JXMROGBWSA-N

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Certificate of Analysis

Certificate of Origin

Tetyana Kobets et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 115, 228-243 (2018-03-20)
Genotoxicity of flavor and fragrance materials was assessed in Turkey Egg Genotoxicity Assay (TEGA) using 32P-nucleotide postlabeling (NPL) and comet assays to detect hepatic DNA adducts and strand breaks. Twenty materials having results in GADD45a-Gluc 'BlueScreen HC' genotoxicity assay, and...

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