Heptylparaben

Molecule SVG Image

Properties Simple | Detailed

Formula C14H20O3
IUPAC Name heptyl 4-hydroxybenzoate
Molecular Mass 236.307 g·mol−1
Heat of Formation -586.7 ± 16.7 kJ·mol−1
Dipole Moment 3.43 ± 1.08 D
Volume 308.65 Å 3
Surface Area 301.41 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy -0.50 ± eV
Point Group Symmetry Cs
Synonyms
  • 4-hydroxybenzoic acid heptyl ester
  • benzoic acid, 4-hydroxy-, heptyl ester
  • benzoic acid, 4-hydroxy-, n-heptyl ester
  • benzoic acid, p-hydroxy-, heptyl ester
  • heptyl p-hydroxybenzoate
  • heptyl paraben
  • n-heptyl 4-hydroxybenzoate
  • n-heptyl p-hydroxybenzoate
  • nipaheptyl
  • p-hydroxybenzoic acid heptyl ester
CAS Number(s)
  • 1085-12-7
InChIKey ZTJORNVITHUQJA-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem Wikipedia ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O