W387401

2-Methyl-1-propanethiol

≥95%, FG

• Synonym(s): Isobutyl mercaptan
• Linear Formula: (CH₃)₂CHCH₂SH
• CAS Number: 513-44-0
• Molecular Weight: 90.19
• FEMA Number: 3874
• Beilstein/REAXYS Number: 1730890
• EC Number: 208-162-6
• MDL number: MFCD00004882
• UNSPSC Code: 12164502
• PubChem Substance ID: 24901910
• Flavis number: 12.173
• NACRES: NA.21
• organoleptic: sulfurous
• grade: FG; Halal; Kosher
• biological source: synthetic
• food allergen: no known allergens

Properties

• biological source: synthetic
• Quality Level: 300; 400
• grade: FG; Halal; Kosher
• reg. compliance: EU Regulation 1334/2008 & 178/2002
• vapor density: 3.1 (vs air)
• vapor pressure: 124 mmHg ( 37.8 °C)
• assay: ≥95%
• refractive index: n20/D 1.4385 (lit.)
• bp: 87-89 °C (lit.)
• density: 0.831 g/mL at 25 °C (lit.)
• application(s): flavors and fragrances
• documentation: see Safety & Documentation for available documents
• food allergen: no known allergens
• organoleptic: sulfurous
• SMILES string: CC(C)CS
• InChI: 1S/C4H10S/c1-4(2)3-5/h4-5H,3H2,1-2H3
• InChI key: BDFAOUQQXJIZDG-UHFFFAOYSA-N

Description

Application

• Targeting the cerebrovascular large neutral amino acid transporter (LAT1) isoform using a novel disulfide-based brain drug delivery system.: This paper discusses a novel brain drug delivery system that targets the LAT1 transporter, using 2-Methyl-1-propanethiol in the design of disulfide-based prodrugs for enhanced delivery across the blood-brain barrier (Killian et al., 2007).

Safety Information

• pictograms: GHS02,GHS07
• signalword: Danger
• hcodes: H225,H315,H319,H335
• pcodes: P210 - P233 - P240 - P241 - P303 + P361 + P353 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 3 - Flammable liquids
• wgk_germany: WGK 3
• flash_point_f: 14.0 °F - closed cup
• flash_point_c: -10 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter