4-{2-[(2-Methyl-2-Propanyl)Amino]-1-[(Methylsulfonyl)Oxy]Ethyl}-1,2-Phenylene Bis(4-Methylbenzoate)

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Properties Simple | Detailed

Formula C29H35NO7S
IUPAC Name [4-[2-(tert-butylamino)-1-methylsulfonyloxyethyl]-2-(4-methylbenzoyl)oxyphenyl] 4-methylbenzoate
Molecular Mass 541.656 g·mol−1
Heat of Formation -1059.6 ± 16.7 kJ·mol−1
Dipole Moment 12.00 ± 1.08 D
Volume 642.59 Å 3
Surface Area 535.62 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry C1
InChIKey RQLSEYZHOFCKJH-SANMLTNESA-N
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