253790

Butyl isothiocyanate

99%

• Synonym(s): NSC 194808
• Linear Formula: CH₃(CH₂)₃NCS
• CAS Number: 592-82-5
• Molecular Weight: 115.20
• Beilstein/REAXYS Number: 906839
• EC Number: 209-770-4
• MDL number: MFCD00004824
• UNSPSC Code: 12352100
• PubChem Substance ID: 24855329
• NACRES: NA.22

Properties

• Quality Level: 200
• assay: 99%
• form: liquid
• refractive index: n20/D 1.5 (lit.)
• bp: 70-71 °C/35 mmHg (lit.)
• density: 0.955 g/mL at 25 °C (lit.)
• functional group: amine; isothiocyanate
• SMILES string: CCCCN=C=S
• InChI: 1S/C5H9NS/c1-2-3-4-6-5-7/h2-4H2,1H3
• InChI key: LIMQQADUEULBSO-UHFFFAOYSA-N

Description

General description

Butyl isothiocyanate is the main component of volatile oil of leaf, ripe fruit and root of Capparis spinosa.

Application

Butyl isothiocyanate has been used as capping reagent to immobilize the functionalized derivative of Oregon Green 514 molecular switch on a preformed amino self assembled monlayer.

Safety Information

• pictograms: GHS08,GHS05,GHS07
• signalword: Danger
• hcodes: H302 + H312 + H332,H314,H317,H334
• pcodes: P261 - P280 - P301 + P312 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Dam. 1 - Resp. Sens. 1 - Skin Corr. 1B - Skin Sens. 1
• Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• wgk_germany: WGK 3
• flash_point_f: 150.8 °F - closed cup
• flash_point_c: 66 °C - closed cup
• ppe: Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter