Formula |
C8H8O4S |
IUPAC Name |
3-hydroxy-4-methoxy-5-sulfanyl-benzoic acid |
Molecular Mass |
200.212 g·mol−1 |
Heat of Formation |
-604.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.22 ± 1.08 D |
Volume |
217.15 Å 3 |
Surface Area |
208.71 Å 2 |
HOMO Energy |
-8.92 ± 0.55 eV |
LUMO Energy |
-1.06 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-hydroxy-5-mercapto-4-methoxy-benzoic acid
- 3-hydroxy-5-mercapto-4-methoxybenzoic acid
- 5-hydroxy-3-mercapto-4-methoxybenzoic acid
- benzoic acid, 3-hydroxy-5-mercapto-4-methoxy-
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CAS Number(s) |
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InChIKey |
AZIKKAGXVJGGCR-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
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