82059

2-Methyl-1-propanol

analytical standard

• Synonym(s): Isobutanol, Isobutyl alcohol
• Linear Formula: (CH₃)₂CHCH₂OH
• CAS Number: 78-83-1
• Molecular Weight: 74.12
• Beilstein/REAXYS Number: 1730878
• EC Number: 201-148-0
• MDL number: MFCD00004740
• UNSPSC Code: 41116107
• PubChem Substance ID: 329769231
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• vapor density: 2.55 (vs air)
• vapor pressure: 8 mmHg ( 20 °C); 8.8 mmHg ( 0 °C)
• assay: ≥99.8% (GC)
• autoignition temp.: 801 °F
• shelf life: limited shelf life, expiry date on the label
• expl. lim.: 10.6 %
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• refractive index: n20/D 1.396 (lit.); n20/D 1.396
• bp: 108 °C (lit.)
• mp: −108 °C (lit.)
• density: 0.803 g/mL at 25 °C (lit.)
• application(s): cleaning products; cosmetics; environmental; flavors and fragrances; food and beverages; personal care
• format: neat
• SMILES string: CC(C)CO
• InChI: 1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
• InChI key: ZXEKIIBDNHEJCQ-UHFFFAOYSA-N

Description

General description

2-Methyl-1-propanol can be obtained via hydroformylation of alkenes with fuel gas mixture in particular, carbon monoxide being the main reactant.

2-Methyl-1-propanol is a potential biofuel, which can be obtained as a major product in the yeast, Saccharomyces cerevisiae using glycine as a substrate through the glycine degradation pathway. It can also be obtained from the disaccharide, cellobionic acid (CBA) in Escherichia coli, via the ascB gene, which is primarily responsible for the CBA metabolism in E.coli.

Application

2-Methyl-1-propanol may be used as an analytical reference standard for the quantification of the analyte in environmental samples using gas chromatography-optical fiber (GC-OF) technique and the obtained analytical results were compared with gas chromatography-flame ionization detector (GC-FID) technique. It may also be used as an analytical reference standard for the quantification of the analyte as decomposition products of alkyl nitrites in biological fluids using capillary gas chromatography (GC) with cryogenic oven trapping.

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Safety Information

• pictograms: GHS02,GHS05,GHS07
• signalword: Danger
• hcodes: H226,H315,H318,H335,H336
• pcodes: P210 - P233 - P240 - P280 - P303 + P361 + P353 - P305 + P351 + P338
• Hazard Classifications: Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
• target_organs: Central nervous system, Respiratory system
• Storage Class: 3 - Flammable liquids
• wgk_germany: WGK 1
• flash_point_f: 82.4 °F - closed cup
• flash_point_c: 28 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter