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548715

Sigma-Aldrich

4-tert-Butylbenzylmercaptan

Synonym(e):

4-tert-Butylbenzenemethanethiol, 4-tert-Butylbenzylthiol, 4-tert-Butylphenylmethanethiol, p-tert-Butylbenzenemethanethiol, p-tert-Butylbenzyl mercaptan

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About This Item

Lineare Formel:
(CH3)3CC6H4CH2SH
CAS-Nummer:
49543-63-7
Molekulargewicht:
180.31
MDL-Nummer:
MFCD00068220
UNSPSC-Code:
12352100
PubChem Substanz-ID:
24879053
NACRES:
NA.22

Brechungsindex

n20/D 1.5430 (lit.)

Qualitätsniveau

100

bp

102-103 °C/3.1 mmHg (lit.)

Dichte

0.966 g/mL at 25 °C (lit.)

SMILES String

CC(C)(C)c1ccc(CS)cc1

InChI

1S/C11H16S/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7,12H,8H2,1-3H3

InChIKey

UIYKSYBJKIMANV-UHFFFAOYSA-N

Verwandte Kategorien

Allgemeine Beschreibung

4-tert-Butylbenzyl mercaptan is a benzyl mercaptan derivative that is commonly used as a ligand for synthesizing metal clusters.

Anwendung

4-tert-Butylbenzyl mercaptan (BBSH) may be used in the preparation of N-Me-aminopyrimidinone derivatives, which are potent state-dependent inhibitor of Nav1.7 (Nav= voltage-gated sodium channel). It may also be used to synthesize organic-soluble, atomically precise array of silver clusters via a novel approach based on the miscibility principle while avoiding the use of phase-transfer agents.
Reactant for:
  • Stereoselective thiourea-catalyzed sulfa-Michael addition
  • Nucleophilic substitution reactions
  • Urea-catalyzed trans-thioesterification
  • Sc-catalyzed Michael addition
  • Copper-catalyzed decarboxylative cross-coupling

Piktogramme

Exclamation mark
GHS07

Signalwort

Warning

Gefahreneinstufungen

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Zielorgane

Respiratory system

Lagerklassenschlüssel

10 - Combustible liquids

WGK

WGK 3

Flammpunkt (°F)

162.0 °F - closed cup

Flammpunkt (°C)

72.2 °C - closed cup

Persönliche Schutzausrüstung

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Analysenzertifikate (COA)

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