Methyl {6-[(4-Hydroxyphenyl)Sulfanyl]-1H-Benzimidazol-2-Yl}Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C15H13N3O3S
IUPAC Name methyl n-[5-(4-hydroxyphenyl)sulfanylbenzimidazol-3-ium-2-yl]carbamate
Molecular Mass 315.347 g·mol−1
Heat of Formation -172.8 ± 16.7 kJ·mol−1
Dipole Moment 6.96 ± 1.08 D
Volume 350.14 Å 3
Surface Area 325.48 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
Synonyms
  • 4-hydroxyfenbendazole
  • 5-(p-hydroxyphenyl)thio-2-carbomethoxyaminobenzimidazole
  • carbamic acid, (5-((4-hydroxyphenyl)thio)-1h-benzimidazol-2-yl)-, methyl ester
  • carbamic acid, (5-((4-hydroxyphenyl)thio)-1h-benzimidazol-2-yl)-,methyl ester
  • fbz-oh
  • fenbendazole hydroxide
  • methyl n-[6-(4-hydroxyphenyl)sulfanyl-1h-benzimidazol-2-yl]carbamate
  • n-[6-[(4-hydroxyphenyl)thio]-1h-benzimidazol-2-yl]carbamic acid methyl ester
CAS Number(s)
  • 72447-64-4
InChIKey KFNQNAKZKBFJAZ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N