2-Hydroxy-5-(2,4,4-Trimethyl-2-Pentanyl)Benzenesulfonic Acid

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Properties Simple | Detailed

Formula C14H22O4S
IUPAC Name 2-hydroxy-5-(1,1,3,3-tetramethylbutyl)benzenesulfonic acid
Molecular Mass 286.387 g·mol−1
Heat of Formation -802.4 ± 16.7 kJ·mol−1
Dipole Moment 5.82 ± 1.08 D
Volume 350.67 Å 3
Surface Area 286.86 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)benzenesulfonic acid
  • benzenesulfonic acid, 2-hydroxy-5-(1,1,3,3-tetramethylbutyl)-
  • p-isooctylphenol-2-sulfonic acid
CAS Number(s)
  • 68959-11-5
InChIKey LSAIQLOHXQZJCH-UHFFFAOYSA-N
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