Merck
CN
All Photos(1)

68488

Supelco

Phenethyl isothiocyanate

analytical standard

All Photos(1)
Synonym(s):
PEITC, 2-Phenylethyl isothiocyanate
Linear Formula:
C6H5CH2CH2NCS
CAS Number:
2257-09-2
Molecular Weight:
163.24
Beilstein:
2084162
EC Number:
218-855-5
MDL number:
MFCD00004821
PubChem Substance ID:
329760932
NACRES:
NA.24

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Phenethyl isothiocyanate 99%

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253731

Phenethyl isothiocyanate

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Allyl isothiocyanate PESTANAL®, analytical standard

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36682

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Benzyl isothiocyanate 98%

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252492

Benzyl isothiocyanate

98%

Allyl isothiocyanate ≥95%, FCC

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W203408

Allyl isothiocyanate

≥95%, FCC

DL-Sulforaphane ≥90% (HPLC), synthetic, liquid

Sigma-Aldrich

S4441

DL-Sulforaphane

≥90% (HPLC), synthetic, liquid

Propyl isothiocyanate 98%

Sigma-Aldrich

253944

Propyl isothiocyanate

98%

Andrographolide 98%

Sigma-Aldrich

365645

Andrographolide

98%

Phenyl isothiocyanate reagent grade, 98%

Sigma-Aldrich

139742

Phenyl isothiocyanate

reagent grade, 98%

D,L-Sulforaphane - CAS 4478-93-7 - Calbiochem An isothiocyanate isolated from broccoli that acts as a potent inducer of phase II detoxifying enzymes in mouse tissues and murine hepatoma cells in culture.

Sigma-Aldrich

574215

D,L-Sulforaphane - CAS 4478-93-7 - Calbiochem

An isothiocyanate isolated from broccoli that acts as a potent inducer of phase II detoxifying enzymes in mouse tissues and murine hepatoma cells in culture.

2-Phenylethyl isothiocyanate FG

Sigma-Aldrich

W401404

2-Phenylethyl isothiocyanate

FG

grade

analytical standard

Quality Level

100

assay

≥98.5% (GC)

shelf life

limited shelf life, expiry date on the label

refractive index

n20/D 1.5888 (lit.)
n20/D 1.589-1.591

bp

139-140 °C/11 mmHg (lit.)

density

1.094 g/mL at 25 °C (lit.)

format

neat

storage temp.

2-8°C

SMILES string

S=C=NCCc1ccccc1

InChI

1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2

InChI key

IZJDOKYDEWTZSO-UHFFFAOYSA-N

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General description

Phenethyl isothiocyanate, an organic isothiocyanate, is a cruciferous vegetable ingredient present as a glucosinolate in cabbage, turnips, radishes, etc. It is a well-known chemopreventive agent reported to be effective against cancers affecting the lung, breast, pancreas, prostate and so on.

Application

Phenethyl isothiocyanate may be used as an analytical standard for the determination of the analyte in biological samples and vegetable extracts by various chromatography techniques.

Pictograms

Exclamation markHealth hazard
GHS07,GHS08

Signal Word

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 Code

6.1C - Combustible, acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Certificate of Analysis

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Certificate of Origin

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