(2S)-3-[Ethyl(3-Methylphenyl)Amino]-2-Hydroxy-1-Propanesulfonic Acid

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Properties Simple | Detailed

Formula C12H19NO4S
IUPAC Name (2s)-3-(n-ethyl-3-methyl-anilino)-2-hydroxy-propane-1-sulfonic acid
Molecular Mass 273.349 g·mol−1
Heat of Formation -728.4 ± 16.7 kJ·mol−1
Dipole Moment 2.59 ± 1.08 D
Volume 320.69 Å 3
Surface Area 286.56 Å 2
HOMO Energy -8.16 ± 0.55 eV
LUMO Energy 0.26 ± eV
Point Group Symmetry C1
InChIKey ZTQGWROHRVYSPW-LBPRGKRZSA-N
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