Phenylethyl isothiocyanate structure
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Common Name | Phenylethyl isothiocyanate | ||
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CAS Number | 2257-09-2 | Molecular Weight | 163.23900 | |
Density | 1.094 g/mL at 25 °C(lit.) | Boiling Point | 75 °C0.25 mm Hg | |
Molecular Formula | C9H9NS | Melting Point | N/A | |
MSDS | Chinese USA | Flash Point | >230 °F | |
Symbol |
GHS07, GHS08 |
Signal Word | Danger |
Use of Phenylethyl isothiocyanate2-Phenylethyl isothiocyanate is a potent antifungal agent. 2-Phenylethyl isothiocyanate significantly inhibited spore germination and mycelial growth of Alternaria alternata, with a MIC (minimum inhibitory concentration) of 1.22 mM. The antifungal effect of 2-Phenylethyl isothiocyanate against Alternaria alternata might be via reduction in toxin content and breakdown of cell membrane integrity[1][2]. |
Name | phenethyl isothiocyanate |
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Synonym | More Synonyms |
Description | 2-Phenylethyl isothiocyanate is a potent antifungal agent. 2-Phenylethyl isothiocyanate significantly inhibited spore germination and mycelial growth of Alternaria alternata, with a MIC (minimum inhibitory concentration) of 1.22 mM. The antifungal effect of 2-Phenylethyl isothiocyanate against Alternaria alternata might be via reduction in toxin content and breakdown of cell membrane integrity[1][2]. |
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Related Catalog | |
References |
Density | 1.094 g/mL at 25 °C(lit.) |
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Boiling Point | 75 °C0.25 mm Hg |
Molecular Formula | C9H9NS |
Molecular Weight | 163.23900 |
Flash Point | >230 °F |
Exact Mass | 163.04600 |
PSA | 44.45000 |
LogP | 2.33190 |
Vapour Pressure | 0.0427mmHg at 25°C |
Index of Refraction | n20/D 1.5888(lit.) |
Water Solubility | insoluble |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
MUTATION DATA
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Symbol |
GHS07, GHS08 |
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Signal Word | Danger |
Hazard Statements | H302 + H312 + H332-H315-H317-H319-H334-H335 |
Precautionary Statements | P261-P280-P305 + P351 + P338-P342 + P311 |
Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
Hazard Codes | Xn:Harmful; |
Risk Phrases | R20/21/22 |
Safety Phrases | S23-S26-S36-S36/37 |
RIDADR | UN 2206 6.1/PG 3 |
WGK Germany | 3 |
RTECS | NX9115000 |
Packaging Group | III |
Hazard Class | 8 |
HS Code | 2930909090 |
Precursor 10 | |
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DownStream 10 | |
HS Code | 2930909090 |
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Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
Phenethyl isothiocyanate, a naturally occurring phytochemical, is an antagonist of the aryl hydrocarbon receptor.
Mol. Nutr. Food. Res. 56(3) , 425-34, (2012) The aryl hydrocarbon (Ah) receptor is a ligand-activated transcription factor that is activated by many carcinogens, and its target gene products play a major role in tumour development, so that antag... |
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Prediction and identification of drug interactions with the human ATP-binding cassette transporter multidrug-resistance associated protein 2 (MRP2; ABCC2).
J. Med. Chem. 51 , 3275-87, (2008) The chemical space of registered oral drugs was explored for inhibitors of the human multidrug-resistance associated protein 2 (MRP2; ABCC2), using a data set of 191 structurally diverse drugs and dru... |
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In vitro metabolic conversion of the organic breakdown products of glucosinolate to goitrogenic thiocyanate anion.
J. Sci. Food Agric. 95 , 2244-51, (2015) Glucosinolates are abundant in Brassicaceae vegetables, and they are degraded into various organic breakdown products (BPs) (R-CN, -NCS and -SCN) by myrosinase when plant tissues are damaged. This stu... |
PhCH2CH2NCS |
Phenylethyl isothiocyanate |
2-Phenylethyl Isothiocyanate |
EINECS 218-855-5 |
PEITC |
Isothiocyanic Acid 2-Phenylethyl Ester |
Phenylaethylsenfoel |
Phenethyl mustard oil |
MFCD00004821 |
Phenethyl Isothiocyanate |
2-phenylethyl-ITC |
2-isothiocyanatoethylbenzene |