N-[7-(Dimethylsulfamoyl)-2,1,3-Benzoxadiazol-4-Yl]-N-Methylglycyl Chloride

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Properties Simple | Detailed

Formula C11H13ClN4O4S
IUPAC Name 2-[[4-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-7-yl]-methyl-amino]acetyl chloride
Molecular Mass 332.763 g·mol−1
Heat of Formation -189.6 ± 16.7 kJ·mol−1
Dipole Moment 8.95 ± 1.08 D
Volume 344.58 Å 3
Surface Area 299.42 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -1.95 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[7-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-4-yl]-methyl-amino]acetyl chloride
  • 2-[[7-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-4-yl]-methyl-amino]ethanoyl chloride
  • 2-[[7-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-4-yl]-methylamino]acetyl chloride
  • 2-[[7-(dimethylsulfamoyl)benzofurazan-4-yl]-methyl-amino]acetyl chloride
  • 4-(n-chloroformylmethyl-n-methyl)amino-7-n,n-dimethylaminosulfonyl-2,1,3-benzoxadiazole
  • 4-(n-chloroformylmethyl-n-methylamino)-7-(n,n-dimethylsulfamoyl)benzofurazan
  • acetyl chloride, ((7-((dimethylamino)sulfonyl)-2,1,3-benzoxadiazol-4-yl)methylamino)-
  • dbd-cocl
  • n-[7-(n,n-dimethylsulfamoyl)-4-benzofurazanyl]methylamino-acetyl chloride
  • n-[7-(n,n-dimethylsulfamoyl)-4-benzofurazanyl]sarcosyl chloride
CAS Number(s)
  • 156153-43-4
InChIKey NAIIBGUHMHXMNS-UHFFFAOYSA-N
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