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Supelco

Allyl isothiocyanate

PESTANAL®, analytical standard

Sinonimo/i:

AITC, Oil of mustard

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About This Item

Formula condensata:
CH2=CHCH2NCS
Numero CAS:
Peso molecolare:
99.15
Beilstein:
773748
Numero CE:
Numero MDL:
Codice UNSPSC:
41116107
ID PubChem:
NACRES:
NA.24

Grado

analytical standard

Livello qualitativo

Nome Commerciale

PESTANAL®

Saggio

99.7% (GC)

Durata

limited shelf life, expiry date on the label

tecniche

HPLC: suitable
gas chromatography (GC): suitable

Indice di rifrazione

n20/D 1.529 (lit.)

P. ebollizione

150 °C (lit.)

Punto di fusione

−80 °C (lit.)

Densità

1.013 g/mL at 25 °C (lit.)

applicazioni

agriculture
cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

Formato

neat

Stringa SMILE

C=CCN=C=S

InChI

1S/C4H5NS/c1-2-3-5-4-6/h2H,1,3H2
ZOJBYZNEUISWFT-UHFFFAOYSA-N

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Descrizione generale

Allyl isothiocyanate is a naturally occurring compound in plants which belongs to the class of cruciferae. It can also serve as a promising candidate that can show anti-cancer activity in both cultured cells and animal models.

Applicazioni

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Azioni biochim/fisiol

Naturally occurring constituent of cruciferous vegetables.

Confezionamento

bottled under inert gas

Note legali

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

Avvertenze

Danger

Classi di pericolo

Acute Tox. 2 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 4 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1B - Skin Sens. 1

Codice della classe di stoccaggio

3 - Flammable liquids

Classe di pericolosità dell'acqua (WGK)

WGK 3

Punto d’infiammabilità (°F)

113.0 °F - closed cup

Punto d’infiammabilità (°C)

45 °C - closed cup


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Certificati d'analisi (COA)

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Antibacterial mechanism of allyl isothiocyanate
Lin C-M, et al.
Journal of Food Protection, 63, 727-734 (2000)
Allyl isothiocyanate as a cancer chemopreventive phytochemical
Zhang Y, et al.
Molecular Nutrition And Food Research, 54, 127-135 (2010)
Wenxuan Chen et al.
International journal of food microbiology, 155(3), 165-170 (2012-03-01)
This study investigated the antimicrobial effect of a chitosan coating+allyl isothiocyanate (AIT) and nisin against Salmonella on whole fresh cantaloupes. Cantaloupes were inoculated with a cocktail of three Salmonella strains and treated with chitosan, chitosan+AIT, chitosan+nisin, and chitosan+AIT+nisin coatings. With
Yuesheng Zhang
Molecular nutrition & food research, 54(1), 127-135 (2009-12-05)
Allyl isothiocyanate (AITC), which occurs in many common cruciferous vegetables, is widely and often frequently consumed by humans. Besides antimicrobial activity against a wide spectrum of pathogens, it showed anticancer activity in both cultured cancer cells and animal models, although
D Jiao et al.
Cancer epidemiology, biomarkers & prevention : a publication of the American Association for Cancer Research, cosponsored by the American Society of Preventive Oncology, 3(6), 487-492 (1994-09-01)
Allyl isothiocyanate (AITC) is a constituent of cruciferous vegetables. It occurs widely in the human diet as a natural ingredient or food additive. AITC possesses numerous biochemical and physiological activities. It is cytotoxic and tumorigenic at high doses and also

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