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2-Ethylhexyl nitrate

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2-Ethylhexyl nitrate Basic information

Product Name:
2-Ethylhexyl nitrate
Synonyms:
  • ethylhexylnitrate
  • Nitricacid,2-ethylhexylester
  • nitronal
  • salpetersaure-(2-ethylhexyl)ester
  • 2-Ethylhexylnitrat
  • OCTYL NITRATE (2-ETHYL HEXYL NITRATE)
  • 2-ETHYLHEXYL NITRATE
  • 2-ETHYL-HEXYL-1-NITRATE
CAS:
27247-96-7
MF:
C8H17NO3
MW:
175.23
EINECS:
248-363-6
Product Categories:
  • Nitrogen Compounds
  • Organic Building Blocks
  • Organic Nitrates/Nitrites
Mol File:
27247-96-7.mol
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2-Ethylhexyl nitrate Chemical Properties

Boiling point:
306.53°C (rough estimate)
Density 
0.963 g/mL at 25 °C(lit.)
vapor pressure 
27Pa at 20℃
refractive index 
n20/D 1.432(lit.)
Flash point:
168 °F
Odor
Fruity, pungent, ester, characteristic
Water Solubility 
12.5mg/L at 20℃
Decomposition 
>100℃
Stability:
Stability Heating may cause an explosion. Contact with combustible material may cause fire or explosion.
InChI
InChI=1S/C8H17NO3/c1-3-5-6-8(4-2)7-12-9(10)11/h8H,3-7H2,1-2H3
InChIKey
NKRVGWFEFKCZAP-UHFFFAOYSA-N
SMILES
[N+]([O-])(=O)OCC(CC)CCCC
LogP
5.24 at 40℃
CAS DataBase Reference
27247-96-7(CAS DataBase Reference)
EPA Substance Registry System
2-Ethylhexyl nitrate (27247-96-7)
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Safety Information

Hazard Codes 
O,Xn,N
Risk Statements 
5-8-20/21/22-36/37/38-66-51/53-44
Safety Statements 
15-26-27-36/37/39-61-60-24/25
OEL
0.25% v/v in air
RIDADR 
UN 3139 5.1/PG 2
WGK Germany 
2
RTECS 
QU7925000
Autoignition Temperature
130℃ - (decomposes)
TSCA 
TSCA listed
HazardClass 
9
Storage Class
10 - Combustible liquids
Hazard Classifications
Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Aquatic Chronic 2

MSDS

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2-Ethylhexyl nitrate Usage And Synthesis

Chemical Properties

solid

Uses

2-Ethylhexyl nitrate (2-EHN) is a major fuel additive, has been used to increase the cetane number of diesel.

General Description

Biodegradation of 2-ethylhexyl nitrate (2-EHN) by Mycobacterium austroafricanum IFP 2173 has been studied. Biodegradation of 2-EHN was studied in biphasic liquid cultures using an inert non-aqueous phase liquid such as 2,2,4,4,6,8,8-heptamethylnonane as solvent.

Flammability and Explosibility

Not classified

Synthesis

A production method of 2-Ethylhexyl nitrate, the steps are: (1) 1500L reactor add 100 kg of 98% nitric acid, water cooling, vigorous stirring under the addition of 424 kg of 87% sulfuric acid, made of sulfuric acid and nitric acid acid mixture; (2) 156 kg of isooctyl nitrate to 195 kg of iso-octanol and mix it well; (3) (2) isooctyl nitrate and iso-octanol mixture prepared by adding to the (1) mixed acid. (3) The mixture of isooctyl nitrate and isooctanol prepared in (2) was added to the mixed acid prepared in (1), the process of adding speed control to keep the reaction temperature between 10-30 ??, add the stirring reaction for 45 minutes, static liquid separation, organic phase alkali washing, water washing, to obtain the product of isooctyl nitrate purity of 99.1%, the yield of 98.2%.

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