75018

1-Hexanethiol

analytical standard

• Sinónimos: 1-Mercaptohexane, Hexyl mercaptan, MCH, Mercaptan C₆
• Fórmula lineal: CH₃(CH₂)₅SH
• Número de CAS: 111-31-9
• Peso molecular: 118.24
• Beilstein: 1731295
• Número CE: 203-857-0
• Número MDL: MFCD00004909
• Código UNSPSC: 85151701
• ID de la sustancia en PubChem: 329766055
• NACRES: NA.24

Propiedades

• grado: analytical standard
• Nivel de calidad: 100
• Análisis: ≥98.0% (GC)
• caducidad: limited shelf life, expiry date on the label
• índice de refracción: n20/D 1.448-1.452; n20/D 1.450
• bp: 150-154 °C (lit.)
• mp: −81-−80 °C (lit.)
• densidad: 0.832 g/mL at 25 °C
• aplicaciones: cleaning products; cosmetics; flavors and fragrances; food and beverages; personal care
• formato: neat
• cadena SMILES: CCCCCCS
• InChI: 1S/C6H14S/c1-2-3-4-5-6-7/h7H,2-6H2,1H3
• Clave InChI: PMBXCGGQNSVESQ-UHFFFAOYSA-N

Descripción

Descripción general

1-Hexanethiol is an organic sulfur compound that belongs to the class of mercaptans. Mercaptans have a characteristic odor and are regarded as the major contributors to several foods and beverage aromas.

Aplicación

1-Hexanethiol may be used as a surrogate standard for the determination of wine polyfunctional mercaptans by gas chromatography−negative ion mass spectrometry analysis of their pentafluorobenzyl derivatives. It may also be used as an analytical standard for the determination of the analyte in alcoholic beverages by simultaneous derivatization/extraction and liquid chromatography-high resolution mass spectrometry.

Información de seguridad

• Pictogramas: GHS02,GHS07
• Palabra de señalización: Warning
• Frases de peligro: H226,H302
• Consejos de prudencia: P210 - P233 - P240 - P241 - P242 - P301 + P312
• Clasificaciones de peligro: Acute Tox. 4 Oral - Flam. Liq. 3
• Código de clase de almacenamiento: 3 - Flammable liquids
• Clase de riesgo para el agua (WGK): WGK 3
• Punto de inflamabilidad (°F): 86.0 °F - closed cup
• Punto de inflamabilidad (°C): 30 °C - closed cup