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253731

Sigma-Aldrich

Phenethyl isothiocyanate

99%

Sinônimo(s):

2-Phenylethyl isothiocyanate

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About This Item

Fórmula linear:
C6H5CH2CH2NCS
Número CAS:
2257-09-2
Peso molecular:
163.24
Beilstein:
2084162
Número CE:
218-855-5
Número MDL:
MFCD00004821
Código UNSPSC:
12352100
ID de substância PubChem:
24855324
NACRES:
NA.22

Ensaio

99%

forma

liquid

índice de refração

n20/D 1.5888 (lit.)

pb

139-140 °C/11 mmHg (lit.)

densidade

1.094 g/mL at 25 °C (lit.)

grupo funcional

amine

temperatura de armazenamento

2-8°C

cadeia de caracteres SMILES

S=C=NCCc1ccccc1

InChI

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

chave InChI

IZJDOKYDEWTZSO-UHFFFAOYSA-N

Informações sobre genes

human ... CYP1A2(1544)

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Descrição geral

Phenethyl isothiocyanate is a naturally occurring isothiocyanate in cruciferous vegetables. Phenethyl isothiocyanate is a chemopreventive agent. It inhibits cancer cell growth by arresting the cell cycle and inducing apoptosis in various human cancer cell models.

Pictogramas

Health hazardExclamation mark
GHS08,GHS07

Palavra indicadora

Danger

Classificações de perigo

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

Órgãos-alvo

Respiratory system

Código de classe de armazenamento

10 - Combustible liquids

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

235.4 °F - closed cup

Ponto de fulgor (°C)

113 °C - closed cup

Equipamento de proteção individual

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificados de análise (COA)

Lot/Batch Number
SHBM9432
SHBL9110
MKCC3781
MKBW5419V
MKBR2547V

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Sigma-Aldrich

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Marilyn E Morris et al.
The AAPS journal, 16(4), 705-713 (2014-05-14)
Phenethyl isothiocyanate (PEITC)-a naturally occurring isothiocyanate in cruciferous vegetables-has been extensively studied as a chemopreventive agent in several preclinical species and in humans. Pharmacokinetic features of unchanged PEITC are (I) linear and first-order absorption, (II) high protein binding and capacity-limited
Yating Wang et al.
Molecular medicine reports, 10(1), 543-549 (2014-05-03)
Phenethyl isothiocyanate (PEITC), a potential cancer chemopreventive constituent of cruciferous vegetables, including watercress, has been reported to inhibit cancer cell growth by arresting the cell cycle and inducing apoptosis in various human cancer cell models. However, the role of PEITC
Ka Lung Cheung et al.
The AAPS journal, 10(2), 277-281 (2008-05-14)
Phenethyl isothiocyanate (PEITC), an isothiocyanate abundantly found in cruciferous vegetables have been shown to induce apoptosis through MAPK pathway in prostate and colon cancer cells. In the present study, we investigate the effect of PEITC on cell cycle regulation of
Jianzhong Zhu et al.
Journal of immunology (Baltimore, Md. : 1950), 190(8), 4400-4407 (2013-03-20)
Naturally occurring isothiocyanates (ITCs) from cruciferous vegetables are widely studied for their cancer chemopreventive effects. In this study, we investigated the effects of ITCs on TLR signaling, and found that the two most promising ITCs, phenethyl ITCs (PEITC) and D,L-sulforaphane
Parul Gupta et al.
BMC medicine, 10, 80-80 (2012-07-25)
HER2 is an oncogene, expression of which leads to poor prognosis in 30% of breast cancer patients. Although trastuzumab is apparently an effective therapy against HER2-positive tumors, its systemic toxicity and resistance in the majority of patients restricts its applicability.
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