1-Nitrobutane

Molecule SVG Image

Properties Simple | Detailed

Formula C4H9NO2
IUPAC Name 1-nitrobutane
Molecular Mass 103.120 g·mol−1
Heat of Formation -137.2 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 133.6 Å 3
Surface Area 146.24 Å 2
HOMO Energy -11.00 ± 0.55 eV
LUMO Energy 3.00 ± eV
Point Group Symmetry C1
Synonyms
  • butane, 1-nitro-
  • n-butyl-n-oxido-hydroxylamine
  • n-butyl-n-oxidohydroxylamine
  • n-hydroxybutan-1-amine oxide
CAS Number(s)
  • 627-05-4
InChIKey NALZTFARIYUCBY-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N