![]() 1-Isothiocyanatobutane structure
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Common Name | 1-Isothiocyanatobutane | ||
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CAS Number | 592-82-5 | Molecular Weight | 115.197 | |
Density | 0.9±0.1 g/cm3 | Boiling Point | 168.0±0.0 °C at 760 mmHg | |
Molecular Formula | C5H9NS | Melting Point | N/A | |
MSDS | Chinese USA | Flash Point | 66.1±0.0 °C | |
Symbol |
![]() ![]() ![]() GHS05, GHS07, GHS08 |
Signal Word | Danger |
Name | butyl isothiocyanate |
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Synonym | More Synonyms |
Density | 0.9±0.1 g/cm3 |
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Boiling Point | 168.0±0.0 °C at 760 mmHg |
Molecular Formula | C5H9NS |
Molecular Weight | 115.197 |
Flash Point | 66.1±0.0 °C |
Exact Mass | 115.045570 |
PSA | 44.45000 |
LogP | 2.53 |
Vapour Pressure | 2.2±0.3 mmHg at 25°C |
Index of Refraction | 1.484 |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA
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Symbol |
![]() ![]() ![]() GHS05, GHS07, GHS08 |
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Signal Word | Danger |
Hazard Statements | H302 + H312 + H332-H314-H317-H334 |
Precautionary Statements | P261-P280-P305 + P351 + P338-P310 |
Personal Protective Equipment | Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
Hazard Codes | C |
Risk Phrases | 20/21/22-34-42 |
Safety Phrases | S23-S26-S36/37-S39-S45 |
RIDADR | UN 1693 6.1/PG 2 |
WGK Germany | 3 |
RTECS | NX8420500 |
Packaging Group | III |
Hazard Class | 8 |
Precursor 8 | |
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DownStream 10 | |
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... |
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Nematicidal Activity of the Volatilome of Eruca sativa on Meloidogyne incognita.
J. Agric. Food Chem. 63 , 6120-5, (2015) Research on new pesticides based on plant extracts, aimed at the development of nontoxic formulates, has recently gained increased interest. This study investigated the use of the volatilome of rucola... |
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Enhanced in vitro biological activity of synthetic 2-(2-pyridyl) ethyl isothiocyanate compared to natural 4-(methylsulfinyl) butyl isothiocyanate.
J. Med. Chem. 55(22) , 9682-92, (2012) Dietary isothiocyanates (ITC) derived from cruciferous vegetables have been shown to have numerous biological effects consistent with chemoprotective activity. In this study we synthesized a novel ITC... |
Butane, 1-isothiocyanato- |
MFCD00004824 |
BUTYL ISOTHIOCYANATE |
1-Isothiocyanatobutane |
EINECS 209-770-4 |