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104-76-7

104-76-7 structural image
Product Name: 2-Ethylhexanol
Formula: C8H18O
Synonyms: 2-Ethyl-1-hexanol;Isocotyl alcohol, Isooctanol;Isooctyl alcohol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical 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. May be toxic by ingestion, inhalation and skin absorption.
Color/Form Colorless liquid
Odor Mild, oily, sweet, slightly floral odor reminiscent of rose
Taste Sweet, fatty-floral taste with fruital note
Boiling Point 363 to 365 °F at 760 mmHg (NTP, 1992)
Melting Point -105 °F (NTP, 1992)
Flash Point 178 °F (NTP, 1992)
Solubility less than 1 mg/mL at 64 °F (NTP, 1992)
Density 0.834 at 68 °F (USCG, 1999) - Less dense than water; will float
Vapor Density 4.49 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 0.05 mmHg at 68 °F (NTP, 1992)
LogP 2.3-3.1
Autoignition Temperature 581 °F (USCG, 1999)
Decomposition When heated to decomp it emits acrid smoke and fumes.
Viscosity 9.8 centapoise at 20 °C
Heat of Combustion -1263.81 kcal/mol at 25 °C
Heat of Vaporization 10.8 kcal/mol at boiling point
Odor Threshold Odor Threshold Low: 0.07 [mmHg] Odor Threshold High: 0.13 [mmHg] [Merck Index] Odor threshold from CHEMINFO
Refractive Index Index of refraction: 1.4300 at 20 °C/D
Kovats Retention Index 1010.7 1010.7 1014.9 1019 1020 1020 1013 1019 1015 1017 1019 1018 1015 1008 1019 1019 1019 1048 1033 1013 1015.4 1020 998 1016.1 1015.5 1015 1012 1020 1015 1015 1012 1012 1015 1018 1014 1018 1018 1016 1064 1013 1037
Other Experimental Properties Freezing point: -76 °C
Chemical Classes Solvents -> Alcohols (<C12)

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H332:Acute toxicity,inhalation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 130.23 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 5
Exact Mass 130.135765193 g/mol
Monoisotopic Mass 130.135765193 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 52.5
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

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. May be toxic by ingestion, inhalation and skin absorption.

RELATED SUPPLIERS

Aero Agro Chemicals Industries Ltd

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