Formula |
C18H20ClNO7 |
IUPAC Name |
2-(3-amino-2,5,6-trimethoxy-phenyl)ethyl 5-chloro-2,4-dihydroxy-benzoate |
Molecular Mass |
397.807 g·mol−1 |
Heat of Formation |
-1086.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.72 ± 1.08 D |
Volume |
435.3 Å 3 |
Surface Area |
392.59 Å 2 |
HOMO Energy |
-8.25 ± 0.55 eV |
LUMO Energy |
-0.73 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 5-chloro-2,4-dihydroxy-benzoic acid 2-(3-amino-2,5,6-trimethoxy-phenyl)ethyl ester
- 5-chloro-2,4-dihydroxybenzoic acid 2-(3-amino-2,5,6-trimethoxyphenyl)ethyl ester
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InChIKey |
DFYGLJKFZQGYPA-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
Cl
O
N
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