The storage temperature of this product is room temperature.
W401404
2-Phenylethyl isothiocyanate
FG
Synonym(s):
Phenethyl isothiocyanate, 2-Phenylethyl isothiocyanate
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1 EACH
$56.20
25 G
$122.00
100 G
$175.00
1 KG
$1,370.00
About This Item
Linear Formula:
C6H5CH2CH2NCS
CAS Number:
Molecular Weight:
163.24
Flavis number:
12.193
PubChem Substance ID:
UNSPSC Code:
12164502
FEMA Number:
4014
NACRES:
NA.21
EC Number:
218-855-5
MDL number:
Beilstein/REAXYS Number:
2084162
Organoleptic:
green; sulfurous
Grade:
FG, Fragrance grade, Halal, Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines
Food allergen:
no known allergens
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InChI
1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2
InChI key
IZJDOKYDEWTZSO-UHFFFAOYSA-N
SMILES string
S=C=NCCc1ccccc1
biological source
synthetic
grade
FG, Fragrance grade, Halal, Kosher
agency
follows IFRA guidelines
reg. compliance
EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002
refractive index
n20/D 1.5888 (lit.)
bp
139-140 °C/11 mmHg (lit.)
density
1.094 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
fragrance allergen
no known allergens
organoleptic
green; sulfurous
Gene Information
human ... CYP1A2(1544)
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Related Categories
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This Item | 253731 | W322120 | W331201 |
|---|---|---|---|
| organoleptic green; sulfurous | organoleptic - | organoleptic honey; floral; woody; waxy; sweet | organoleptic pungent; vegetable; sulfurous |
| grade FG, Halal, Fragrance grade, Kosher | grade - | grade FG, Fragrance grade, Halal, Kosher, natural (US) | grade FG, Halal, Kosher |
| biological source synthetic | biological source - | biological source botanical | biological source synthetic |
| food allergen no known allergens | food allergen - | food allergen no known allergens | food allergen no known allergens |
| agency follows IFRA guidelines | agency - | agency follows IFRA guidelines | agency meets purity specifications of JECFA |
| documentation see Safety & Documentation for available documents | documentation - | documentation see Safety & Documentation for available documents | documentation see Safety & Documentation for available documents |
General description
2-Phenylethyl isothiocyanate (2-PE ITC) is a bioactive isothiocyanate mainly found in Brassica vegetables.[1][2] It is produced by the enzymatic hydrolysis of 2-phenylethyl glucosinolate.[3] 2-PE ITC is the main compound responsible for the nematicidal effect of Brassica root tissues against (Pratylenchus neglectus Filipjev), a root-lesion nematode. This ability makes it a promising candidate for the development of soil fumigants.[4]
signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
235.4 °F - closed cup
flash_point_c
113 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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Reduced susceptibility of Brassica napus to Pratylenchus neglectus in plants with elevated root levels of 2-phenylethyl glucosinolate.
Potter MJ, et al.
Journal of Nematology, 31(3), 291-291 (1999)
In vitro inhibition of soil microorganisms by 2?phenylethyl isothiocyanate.
Smith BJ & Kirkegaard JA
Plant Pathology, 51(5), 585-593 (2002)
Antibacterial activity and synergistic effect between watercress extracts, 2?phenylethyl isothiocyanate and antibiotics against 11 isolates of Escherichia coli from clinical and animal source.
Freitas E, et al.
Letters in Applied Microbiology, 57(4), 266-273 (2013)
Evaluation of Antibacterial Activity of 3?Butenyl, 4?Pentenyl, 2?Phenylethyl, and Benzyl Isothiocyanate in Brassica Vegetables
Jang M, et al.
Journal of Food Science, 75(7) (2010)
Breeze E Cavell et al.
Journal of natural products, 75(6), 1051-1057 (2012-05-23)
Phenethyl isothiocyanate (1) is a natural dietary phytochemical with cytostatic, cytotoxic, and antitumor activity. The effects of 1 were investigated on the activity of mTOR, a kinase that enhances the translation of many RNAs encoding proteins critical for cancer cell
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