3-{5-[4-(Cyclopentyloxy)-2-Hydroxybenzoyl]-2-[(3-Oxo-2,3-Dihydro-1,2-Benzoxazol-6-Yl)Methoxy]Phenyl}Propanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C29H27NO8
IUPAC Name 3-[5-[4-(cyclopentoxy)-2-hydroxy-benzoyl]-2-[(3-oxo-1,2-benzoxazol-6-yl)methoxy]phenyl]propanoic acid
Molecular Mass 517.527 g·mol−1
Heat of Formation -994.2 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 592.72 Å 3
Surface Area 501.16 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy 1.92 ± eV
Point Group Symmetry C1
InChIKey DALCQQSLNPLQFZ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N