{[(3-Chloropropyl)Sulfonyl]Methyl}Benzene

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Properties Simple | Detailed

Formula C10H13ClO2S
IUPAC Name 3-chloropropylsulfonylmethylbenzene
Molecular Mass 232.727 g·mol−1
Heat of Formation -338.4 ± 16.7 kJ·mol−1
Dipole Moment 3.06 ± 1.08 D
Volume 264.83 Å 3
Surface Area 246.56 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 0.01 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 90875-94-8
InChIKey JTUKZELJXQSUNH-UHFFFAOYSA-N
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Elements H S C O Cl