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2-Ethyl-1-hexanol

2-Ethylhexanol (abbreviated 2-EH) or Octanol is a branched, eight-carbon chiral alcohol. It is a colorless liquid that is poorly soluble in water but soluble in most organic solvents. 2-Ethyl hexanol is an 8-carbon higher alcohol species. It is used to make the vinyl chloride plasticizer, bis(2-ethyl hexyl) phthalate. It is also used to make 2-ethyl hexyl acrylate for adhesives and paints. Most common application as a feedstock in the production of plasticizers and lubricants, where its presence helps reduce viscosity and lower freezing points.

  • Synonym(s): Isooctyl alcohol, (±)-2-Ethyl-1-hexanol; 2-Ethyl-1-hexanol; 2-Ethyl-1-hexyl alcohol; 2-Ethylhexanol; 2-Ethylhexyl alcohol; Conol 10WS; Ethylhexanol; G 301; Guerbet C8; NSC 9300
  • Linear Formula: CH3(CH2)3CH(C2H5)CH2OH
  • CAS Number: 104-76-7
  • EC Number: 203-234-3
  • Molecular Weight: 130.23
SKU: JY2301241052 Category: Tags: , Manufacturer and Supplier: Subsidiary of Junyuan Petroleum Group -

Description

2-ethyl hexanol appears as a dark brown liquid with an aromatic odor. Insoluble in water and less dense than water. Flash point between 140 – 175 °F. Contact may irritate skin, eyes and mucous membranes.

Xi-2-ethyl-1-hexanol, also known as 2-ethylhexyl alcohol or octyl alcohol, is a member of the class of compounds known as fatty alcohols. Fatty alcohols are aliphatic alcohols consisting of a chain of a least six carbon atoms. Thus, xi-2-ethyl-1-hexanol is considered to be a fatty alcohol lipid molecule. Xi-2-ethyl-1-hexanol is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Xi-2-ethyl-1-hexanol can be found in a number of food items such as tea, cereals and cereal products, fats and oils, and alcoholic beverages, which makes xi-2-ethyl-1-hexanol a potential biomarker for the consumption of these food products. Xi-2-ethyl-1-hexanol can be found primarily in feces and saliva. Xi-2-ethyl-1-hexanol exists in all eukaryotes, ranging from yeast to humans.

Key Spec Table

CAS # EC Number Hill Formula Chemical Formula Molar Mass
104-76-7 203-234-3 C₈H₁₈O CH₃CH₂CH₂CH₂CH(C₂H₅)CH₂OH 130.23 g/mol

Applications

2-Eethyl hexanol is used to make plasticizers for polyvinyl chloride.  Reaction with phthalic anhydride gives   bis(2-ethyl hexyl) phthalate (DOP, DEHP).  Reaction with adipic acid gives bis(2-ethyl hexyl) adipate.
Moreover, esterification with acrylic acid gives 2-ethyl hexyl acrylate for use in adhesives and paints.
On the other hand, because it can dissolve many organic materials well, 2-ethyl hexanol is widely used as a low-volatility solvent.

  • Adhesives/sealants
  • Agriculture intermediates
  • Auto refinish
  • Coating & Paints Products
  • Construction chemicals
  • Gasoline intermediates
  • Industrial fuel intermediates
  • Lubricants
  • Plasticizer
  • Process solvents
  • Soap/detergents
  • Wetting agent
Packaging : Bulk, Drum, IBC

2-Ethyl-1-Hexanol pure, 99%

CAS# 104-76-7
Molecular Formula : C8H18O
Molecular Weight : 130.23
Part B
Storage : Room Temperature
Shelf Life : 60 Months
HSN Code : 29051620
IMDG Identification :Not Regulated for Transport (Non-Haz)

Product Information

Name:
2-Ethyl-1-hexanol
Synonyms:
  • 2-Ethylhexyl Alcohol
  • Octanol
  • Octyl Alcohol
  • (.+-.)-2-Ethyl-1-hexanol
  • 2-Aethyl-1-Hexanol
  • 2-Ethyl hexanol
  • 2-Ethyl-1-hexyl alcohol
  • 2-Ethylhexan-1-ol
  • 2-Ethylhexane-1-Ol
  • 2-Ethylhexanol
  • 2-Ethylhexyl alcohol
  • 2-Etilhexan-1-Ol
  • Conol 10WS
  • Ethylhexanol
  • G 301
  • Guerbet C8
  • Hexan-1-Ol, 2-Ethyl-
  • Nsc 9300
CAS: 104-76-7
Notes:

EC Number: 203-234-3
Merck Index (14): 3808
Physical State (20 deg.C): Liquid
PubChem Substance ID: 87569421
Purity(GC): min. 99.5 %
RTECS#: MP0350000
Reaxys Registry Number: 1719280
Refractive Index: 1.43
SDBS (AIST Spectral DB): 792
Signal Word: Warning


Chemical properties

Molecular weight: 130.23
Formula: C8H18O
Purity: >99.5%(GC)
Color/Form: Colorless clear liquid
InChI: InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
InChI key: InChIKey=YIWUKEYIRIRTPP-UHFFFAOYSA-N
SMILES: CCCCC(CC)CO
MDL: MFCD00004746
Boiling point: 187 °C
Flash point: 78 °C
HS code: 2905168500
Description
Catalogue Number 800990
Synonyms Isocotyl alcohol, Isooctanol
Description 2-Ethyl-1-hexanol
Product Information
CAS number 104-76-7
EC number 203-234-3
Hill Formula C₈H₁₈O
Chemical formula CH₃CH₂CH₂CH₂CH(C₂H₅)CH₂OH
Molar Mass 130.23 g/mol
HS Code 2905 16 85
Structure formula Image
Quality Level ISO9001
Applications
Application 2-Ethyl-1-hexanol for synthesis. CAS 104-76-7, chemical formula CH₃CH₂CH₂CH₂CH(C₂H₅)CH₂OH.
Physicochemical Information
Boiling point 184 °C (1013 hPa)
Density 0.833 g/cm3 (20 °C)
Explosion limit 1.1 – 12.7 %(V)
Flash point 75 °C DIN 51758
Ignition temperature 270 – 330 °C DIN 51794
Melting Point -89 °C
pH value 7 (1 g/l, H₂O, 20 °C)
Vapor pressure 0.93 hPa (20 °C)
Solubility 1.1 g/l
Toxicological Information
LD 50 oral LD50 Rat 3730 mg/kg
LD 50 dermal LD50 Rat > 3000 mg/kg
Safety Information according to GHS
Hazard Pictogram(s)
Hazard Statement(s) H315: Causes skin irritation.
H319: Causes serious eye irritation.
H332: Harmful if inhaled.
H335: May cause respiratory irritation.
Precautionary Statement(s) P261: Avoid breathing dust/ fume/ gas/ mist/ vapours/ spray.
P264: Wash skin thoroughly after handling.
P271: Use only outdoors or in a well-ventilated area.
P302 + P352: IF ON SKIN: Wash with plenty of water.
P304 + P340 + P312: IF INHALED: Remove person to fresh air and keep comfortable for breathing. Call a POISON CENTER/doctor if you feel unwell.
P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
Signal Word Warning
RTECS MP0350000
Storage class 10 – 13 Other liquids and solids
WGK WGK 1 slightly hazardous to water
Disposal 1 Strongly contaminated halogen-free organic solvents: container A.
Safety Information
Categories of danger irritant
Storage and Shipping Information
Storage Store below +30°C.
Transport Information
Declaration (railroad and road) ADR, RID Kein Gefahrgut
Declaration (transport by air) IATA-DGR UN 3334 , 9, III
Declaration (transport by sea) IMDG-Code No Dangerous Good
Specifications
Assay (GC, area%) ≥ 99 %
Density (d 20 °C/ 4 °C) 0.832 – 0.833
Water (K. F.) ≤ 0.2 %
Identity (IR) passes test

Hazard Info

H Statements:
H312: Harmful in contact with skin.
H315: Causes skin irritation.
H319: Causes serious eye irritation.
H335: May cause respiratory irritation.
H336: May cause drowsiness or dizziness.
H361: Suspected of damaging fertility or the unborn child.
P Statements:
P201: Obtain special instructions before use.
P261: Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP].
P264: Wash thoroughly after handling.
P280: Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352+P312: IF ON SKIN:  Wash with plenty of soap and water. Call a POISON CENTER or doctor/physician if you feel unwell.
P304+P340+P312: IF INHALED:  Remove person to fresh air and keep comfortable for breathing. Call a POISON CENTER or doctor/physician if you feel unwell.
Hazard Info:
Harmful in contact with skin. Causes skin irritation. Causes serious eye irritation. May cause respiratory irritation. May cause drowsiness or dizziness. Suspected of damaging fertility. Suspected of damaging the unborn child.
Specifications
Appearance (Clarity) Clear
Appearance (Colour) Colourless
Appearance (Form) Liquid
Assay (GC) min. 99%
Density (g/ml) @ 20°C 0.830-0.833
Refractive Index (20°C) 1.431-1.432
Boiling Range 181-185°C
Water (KF) max. 0.2%

2-Ethyl-1-hexanol, 99%

MDL
MFCD00004746
EINECS
203-234-3

Chemical Properties

Formula: C8H18O
Formula Weight: 130.23
Melting point: -76°
Boiling Point: 183-186°
Flash Point: 77°(171°F)
Density: 0.833
Refractive Index: 1.4310
Storage & Sensitivity: Ambient temperatures.
Solubility: Miscible with common organic solvents. Immiscible with water.

Applications

2-Ethyl-1-hexanol is used as a flavor, fragrance and plasticizer. It is used to prepare diesters bis(2-ethylhexyl) phthalate. It reacts with nitric acid and used as an octane booster. Its ester, 2-ethylhexyl ester is a component of sunscreen octocrylene. Further, it is used as a low volatility solvent for resins, animal fats, waxes, vegetable oils and petroleum derivatives. In addition to this, it is used in plasticizer, dioctyl phthalate, which is used in the production of polyvinyl chloride products.

Notes

Incompatible with strong oxidizing agents, alkalies, strong bases and strong acids.

GHS Hazard and Precautionary Statements

Hazard Statements: H227-H315-H319-H332-H335

Combustible liquid. Causes skin irritation. Causes serious eye irritation. Harmful if inhaled. May cause respiratory irritation.

Precautionary Statements: P210-P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362+P364-P403+P233-P501c

Keep away from heat/sparks/open flames/hot surfaces. – No smoking. Avoid breathing dust/fume/gas/mist/vapours/spray. Wash face, hands and any exposed skin thoroughly after handling Use only outdoors or in a well-ventilated area. Wear protective gloves/protective clothing/eye protection/face protection. IF ON SKIN: Wash with plenty of soap and water. IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing. IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Call a POISON CENTER or doctor/physician if you feel unwell. Take off contaminated clothing and wash before reuse. And wash it before reuse. Store in a well-ventilated place. Keep container tightly closed. Dispose of contents/ container to an approved waste disposal plant

Other References

Merck: 14,3808
Beilstein: 1719280
Harmonized Tariff Code: 2905.16
TSCA: Yes

PROPERTIES

vapor density

4.49 (vs air)

vapor pressure

0.2 mmHg ( 20 °C)

assay

≥99.6%

autoignition temp.

550 °F

expl. lim.

0.88 %, 104 °F
9.7 %, 113 °F

refractive index

n20/D 1.431 (lit.)

bp

183-186 °C (lit.)

mp

−76 °C (lit.)

solubility

water: soluble g/L at 20 °C

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

 

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