Isothiocyanatoethane

Modify Date: 2024-01-02 18:18:10

Isothiocyanatoethane structure	Common Name	Isothiocyanatoethane
	CAS Number	542-85-8	Molecular Weight	87.144
	Density	0.9±0.1 g/cm3	Boiling Point	131.3±3.0 °C at 760 mmHg
	Molecular Formula	C₃H₅NS	Melting Point	-6 °C
	MSDS	Chinese USA	Flash Point	32.2±0.0 °C
	Symbol	GHS02, GHS05, GHS06, GHS08, GHS09	Signal Word	Danger

Name	ethyl isothiocyanate
Synonym	More Synonyms

Density	0.9±0.1 g/cm3
Boiling Point	131.3±3.0 °C at 760 mmHg
Melting Point	-6 °C
Molecular Formula	C₃H₅NS
Molecular Weight	87.144
Flash Point	32.2±0.0 °C
Exact Mass	87.014267
PSA	44.45000
LogP	1.47
Vapour Pressure	11.5±0.2 mmHg at 25°C
Index of Refraction	1.486
Storage condition	Flammables area

Isothiocyanatoethane MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NX8590000

CHEMICAL NAME :: Isothiocyanic acid, ethyl ester

CAS REGISTRY NUMBER :: 542-85-8

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C3-H5-N-S

MOLECULAR WEIGHT :: 87.15

WISWESSER LINE NOTATION :: SCN2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 100 ug/plate

REFERENCE :: ABCHA6 Agricultural and Biological Chemistry. (Maruzen Co. Ltd., POB 5050, Tokyo International, Tokyo 100-31, Japan) V.25- 1961- Volume(issue)/page/year: 44,3017,1980

Symbol	GHS02, GHS05, GHS06, GHS08, GHS09
Signal Word	Danger
Hazard Statements	H226-H301-H311-H314-H331-H334-H400
Precautionary Statements	P261-P273-P280-P301 + P310-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	T:Toxic;
Risk Phrases	R10;R23/24/25;R34
Safety Phrases	S23-S26-S36/37/39-S45-S61
RIDADR	UN 3286 3/PG 2
WGK Germany	3
RTECS	NX8590000
Packaging Group	II
Hazard Class	6.1
HS Code	2930909090

Precursor 9
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DownStream 10
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HS Code	2930909090
Summary	2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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...

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...

Metabolism of some naturally occurring isothiocyanates in the rat.

Xenobiotica 13(4) , 203-7, (1983)

The metabolism of methyl, ethyl, butyl and allyl isothiocyanate, which occur as glucosinolates in a number of plants, was studied. Oral administration of the substances to the rat was followed by thei...

EINECS 208-831-2

Ethane, isothiocyanato-

MFCD00004820

Isothiocyanatoethane

Ethyl isothiocyanate