Nitroethane

Base Information Edit

Chemical Name:Nitroethane
CAS No.:79-24-3
Molecular Formula:C2H5NO2
Molecular Weight:75.0672
Hs Code.:2904.20 Orl rat LD50: 1635 mg/kg
European Community (EC) Number:201-188-9
ICSC Number:0817
NSC Number:8800
UN Number:2842
UNII:6KEL3ZAU0V
DSSTox Substance ID:DTXSID8020969
Nikkaji Number:J3.837G
Wikipedia:Nitroethane
Wikidata:Q417316
Metabolomics Workbench ID:50439
ChEMBL ID:CHEMBL15625
Mol file:79-24-3.mol

Synonyms:ethylnitronate;nitroethane

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Chemical Property of Nitroethane Edit

Chemical Property:

Appearance/Colour:colourless oily liquid with an unpleasant odour
Vapor Pressure:29.4mmHg at 25°C
Melting Point:-90 °C
Refractive Index:n20/D 1.391(lit.)
Boiling Point:109.2 °C at 760 mmHg
PKA:8.57±0.10(Predicted)
Flash Point:32.8 °C
PSA：45.82000
Density:1.009 g/cm³
LogP:0.80620
Water Solubility.:4.6 g/100 mL (20℃)
XLogP3:0.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:75.032028402
Heavy Atom Count:5
Complexity:37.4
Transport DOT Label:Flammable Liquid

Purity/Quality:

Safty Information:

Pictogram(s): T, Xn
Hazard Codes: Xn:Harmful;
Statements: R10:; R20/22:;
Safety Statements: S25:; S41:; S9:;

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Nitrogen Compounds -> Nitros, Aliphatic
Canonical SMILES:CC[N+](=O)[O-]
Inhalation Risk:A harmful contamination of the air will be reached quickly on evaporation of this substance at 20 °C.
Effects of Short Term Exposure:The substance is irritating to the eyes and respiratory tract. The substance may cause effects on the blood. This may result in the formation of methaemoglobin. Exposure at high levels could cause lowering of consciousness. The effects may be delayed. Medical observation is indicated.
Effects of Long Term Exposure:The substance may have effects on the upper respiratory tract, blood, liver and kidneys.

Technology Process of Nitroethane

There total 77 articles about Nitroethane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: