Formula |
C13H13NO7 |
IUPAC Name |
2-acetoxy-5-(3-carboxypropanoylamino)benzoic acid |
Molecular Mass |
295.245 g·mol−1 |
Heat of Formation |
-1234.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.50 ± 1.08 D |
Volume |
322.88 Å 3 |
Surface Area |
302.29 Å 2 |
HOMO Energy |
-9.16 ± 0.55 eV |
LUMO Energy |
2.08 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-acetoxy-5-[(4-hydroxy-1,4-dioxobutyl)amino]benzoic acid
- 2-acetoxy-5-[(4-hydroxy-4-keto-butanoyl)amino]benzoic acid
- 2-acetoxy-5-[(4-hydroxy-4-oxo-butanoyl)amino]benzoic acid
- 2-acetyloxy-5-[(4-hydroxy-4-oxo-butanoyl)amino]benzoic acid
- 2-acetyloxy-5-[(4-hydroxy-4-oxobutanoyl)amino]benzoic acid
- 5-n-succinylamino aspirin
- benzoic acid, 2-(acetyloxy)-5-((3-carboxy-1-oxopropyl)amino)-
- succinylamino aspirin
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CAS Number(s) |
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InChIKey |
VFDVUQIMTFIYKU-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
C
O
N
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