Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: N-Ethyl-4-nitroaniline
RN: 3665-80-3
UNII: HIJ38TTD80
InChIKey: XBNNLAWQCMDISJ-UHFFFAOYSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C8-H10-N2-O2

Molecular Weight

  • 166.179
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • N-Ethyl-4-nitroaniline

Synonyms

  • EINECS 222-927-1
  • N-Ethyl-p-nitroaniline
  • UNII-HIJ38TTD80

Systematic Names

  • Benzenamine, N-ethyl-4-nitro-
  • N-Ethyl-4-nitroaniline

Registry Numbers

CAS Registry Number

  • 3665-80-3

FDA UNII

  • HIJ38TTD80

System Generated Number

  • 0003665803

Structure Descriptors

InChI

1S/C8H10N2O2/c1-2-9-7-3-5-8(6-4-7)10(11)12/h3-6,9H,2H2,1H3

InChIKey

XBNNLAWQCMDISJ-UHFFFAOYSA-N

Smiles

c1(ccc(NCC)cc1)[N+](=O)[O-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 96-98 deg C   EXP
log P (octanol-water) 2.510 (none)   EST
Water Solubility 461 mg/L 25 EST
Vapor Pressure 2.57E-03 mm Hg 25 EST
Henry's Law Constant 2.19E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.42E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.