ChemSpider 2D Image | aci-nitroethane | C2H5NO2

aci-nitroethane

  • Molecular FormulaC2H5NO2
  • Average mass75.067 Da
  • Monoisotopic mass75.032028 Da
  • ChemSpider ID31150425

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1E)-Ethylidenazinsäure [German] [ACD/IUPAC Name]
(1E)-Ethylideneazinic acid [ACD/IUPAC Name]
Acide (1E)-éthylidèneazinique [French] [ACD/IUPAC Name]
aci-nitroethane
Ethane, aci-nitro-, (1E)- [ACD/Index Name]
ethylnitronate ylide
ethylideneazinic acid
ethylnitronate
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:77894

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 221.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 53.3±6.0 kJ/mol
Flash Point: 113.2±11.1 °C
Index of Refraction: 1.462
Molar Refractivity: 18.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.02
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 49 Å2
Polarizability: 7.4±0.5 10-24cm3
Surface Tension: 34.7±3.0 dyne/cm
Molar Volume: 68.1±3.0 cm3

Click to predict properties on the Chemicalize site


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