N-Pentyl Nitrite

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Properties Simple | Detailed

Formula C5H11NO2
IUPAC Name pentyl nitrite
Molecular Mass 117.146 g·mol−1
Heat of Formation -174.2 ± 16.7 kJ·mol−1
Dipole Moment 2.55 ± 1.08 D
Volume 157.01 Å 3
Surface Area 170.66 Å 2
HOMO Energy -10.32 ± 0.55 eV
LUMO Energy 2.75 ± eV
Point Group Symmetry Cs
Synonyms
  • n-amyl nitrite
  • nitrous acid amyl ester
  • nitrous acid, pentyl ester
  • pentyl alcohol, nitrite
CAS Number(s)
  • 463-04-7
InChIKey CSDTZUBPSYWZDX-UHFFFAOYSA-N
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