Formula |
C8H8O7S |
IUPAC Name |
2-(3-hydroxy-4-sulfooxy-phenyl)acetic acid |
Molecular Mass |
248.210 g·mol−1 |
Heat of Formation |
-1175.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.54 ± 1.08 D |
Volume |
246.1 Å 3 |
Surface Area |
235.5 Å 2 |
HOMO Energy |
-9.33 ± 0.55 eV |
LUMO Energy |
-1.21 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-(3-hydroxy-4-sulfooxy-phenyl)ethanoic acid
- 2-(3-hydroxy-4-sulfooxyphenyl)acetic acid
- 2-(3-hydroxy-4-sulfoxy-phenyl)acetic acid
- 3-hydroxy-4-(sulfooxy)benzeneacetic acid
- sulfonyloxydihydroxyphenylacetic acid
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CAS Number(s) |
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InChIKey |
ZQTJTTSZJNFQGJ-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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