1.94605

Isooctane

for analysis EMPARTA^® ACS

• Synonym(s): 2,2,4-Trimethylpentane, Isooctane
• Linear Formula: (CH₃)₂CHCH₂C(CH₃)₃
• CAS Number: 540-84-1
• Molecular Weight: 114.23
• Beilstein/REAXYS Number: 1696876
• MDL number: MFCD00008943
• UNSPSC Code: 12352001
• Grade: ACS reagent
• Bp: 98-99 °C (lit.)
• Vapor pressure: 41 mmHg ( 21 °C)

Properties

• grade: ACS reagent
• Quality Level: 200
• vapor density: 3.9 (vs air)
• vapor pressure: 41 mmHg ( 21 °C)
• autoignition temp.: 745 °F
• expl. lim.: 6 %
• dilution: (for routine analytical applications)
• refractive index: n20/D 1.391 (lit.)
• bp: 98-99 °C (lit.)
• mp: −107 °C (lit.)
• density: 0.692 g/mL at 25 °C (lit.)
• storage temp.: room temp
• SMILES string: CC(C)CC(C)(C)C
• InChI: 1S/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H3
• InChI key: NHTMVDHEPJAVLT-UHFFFAOYSA-N

Description

General description

EMPARTA solvents are designed for routine chemical synthesis, drying, purification, and critical labware cleaning in quality control environments. Engineered for precision, they deliver consistently reproducible results essential for rigorous validation and documentation.

Exceptional Quality Standards: These solvents meet or exceed ACS specifications, providing assurance of high quality that is crucial for accurate testing and analysis in quality control.

Consistent Reproducibility: Designed for precision, the solvents ensure that results can be reliably reproduced, which is vital for maintaining compliance and integrity in quality control processes.

Versatile Applications: Suitable for a variety of QC tasks, including analytical testing, method validation, and testing USP/NF monographs, these solvents support a comprehensive approach to quality assurance in laboratory settings.

Legal Information

EMPARTA is a registered trademark of Merck KGaA, Darmstadt, Germany

Safety Information

• pictograms: GHS02,GHS08,GHS07,GHS09
• signalword: Danger
• hcodes: H225,H304,H315,H336,H410
• pcodes: P210 - P233 - P273 - P301 + P310 - P303 + P361 + P353 - P331
• Hazard Classifications: Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Central nervous system
• Storage Class: 3 - Flammable liquids
• wgk_germany: WGK 2
• flash_point_f: 10.4 °F - closed cup
• flash_point_c: -12 °C - closed cup