{2-[(Z)-(3-Allyl-4-Oxo-2-Thioxo-1,3-Thiazolidin-5-Ylidene)Methyl]Phenoxy}Acetic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C15H13NO4S2
IUPAC Name 2-[2-[(z)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
Molecular Mass 335.398 g·mol−1
Heat of Formation -354.2 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 374.67 Å 3
Surface Area 306.7 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(3-allyl-4-oxo-2-thioxo-5-thiazolidinylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]ethanoic acid
  • 2-[2-[(z)-(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(z)-(3-allyl-4-oxo-2-thioxo-5-thiazolidinylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(z)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid
  • 2-[2-[(z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]ethanoic acid
CAS Number(s)
  • 92554-19-3
InChIKey DTMDNGZSIMSHAK-WQLSENKSSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N