1-(2-{[3-(Dimethylamino)Propyl]Sulfanyl}Phenyl)-3-Methylurea

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Properties Simple | Detailed

Formula C13H21N3OS
IUPAC Name 1-[2-[3-(dimethylamino)propylsulfanyl]phenyl]-3-methyl-urea
Molecular Mass 267.390 g·mol−1
Heat of Formation -113.4 ± 16.7 kJ·mol−1
Dipole Moment 2.69 ± 1.08 D
Volume 337.88 Å 3
Surface Area 319.89 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[2-(3-dimethylaminopropylsulfanyl)phenyl]-3-methyl-urea
  • 1-[2-(3-dimethylaminopropylsulfanyl)phenyl]-3-methylurea
  • 1-[2-(3-dimethylaminopropylthio)phenyl]-3-methyl-urea
  • 1-[2-(3-dimethylaminopropylthio)phenyl]-3-methylurea
  • sq 11,447
  • sq 11447
  • urea, n-(2-((3-(dimethylamino)propyl)thio)phenyl)-n'-methyl-
CAS Number(s)
  • 33406-68-7
InChIKey LNAUGIJFFGNNRW-UHFFFAOYSA-N
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