04050

2-Ethyl-1-hexanol

puriss., ≥99.0% (GC)

• Synonym(s): Isooctyl alcohol
• Linear Formula: CH₃(CH₂)₃CH(C₂H₅)CH₂OH
• CAS Number: 104-76-7
• Molecular Weight: 130.23
• Beilstein/REAXYS Number: 1719280
• EC Number: 203-234-3
• MDL number: MFCD00004746
• UNSPSC Code: 12352100
• PubChem Substance ID: 329747861
• NACRES: NA.22

Properties

• vapor density: 4.49 (vs air)
• Quality Level: 200
• vapor pressure: 0.2 mmHg ( 20 °C)
• grade: puriss.
• assay: ≥99.0% (GC)
• form: liquid
• autoignition temp.: 550 °F
• expl. lim.: 0.88 %, 104 °F; 9.7 %, 113 °F
• refractive index: n20/D 1.431 (lit.); n20/D 1.431
• bp: 183-186 °C (lit.)
• mp: −76 °C (lit.)
• density: 0.833 g/mL at 25 °C (lit.)
• SMILES string: CCCCC(CC)CO
• InChI: 1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
• InChI key: YIWUKEYIRIRTPP-UHFFFAOYSA-N

Description

Application

• 2-Ethyl-1-hexanol is widely used in the synthesis of bis(2-ethylhexyl) phthalate (DEHP), a well-known plasticizer.
• It can be used in the ring-opening alcoholysis of epoxidized vegetable ois to prepare bio-lubricants with low pour point.
• It is employed as an organic solvent for applications such as post-synthetic modification of metal-organic frameworks (MOFs) and esterification reaction of triphenylenes to synthesize liquid crystals.
• It can also be used as a solvent and in the preparation of nanocrystalline titania thin films by screen printing.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H332,H335
• pcodes: P261 - P264 - P271 - P302 + P352 - P304 + P340 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Inhalation - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• wgk_germany: WGK 1
• flash_point_f: closed cup
• flash_point_c: closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter