Formula |
C12H16O5 |
IUPAC Name |
pentyl 3,4,5-trihydroxybenzoate |
Molecular Mass |
240.252 g·mol−1 |
Heat of Formation |
-892.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.82 ± 1.08 D |
Volume |
286.68 Å 3 |
Surface Area |
279.06 Å 2 |
HOMO Energy |
-9.27 ± 0.55 eV |
LUMO Energy |
-0.75 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 3,4,5-trihydroxybenzoic acid amyl ester
- 3,4,5-trihydroxybenzoic acid pentyl ester
|
InChIKey |
IIOADSXXVWNOSC-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
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