Formula |
C16H13NO2S |
IUPAC Name |
3-(2-phenyl-1,3-benzothiazol-5-yl)propanoic acid |
Molecular Mass |
283.345 g·mol−1 |
Heat of Formation |
-121.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.37 ± 1.08 D |
Volume |
329.29 Å 3 |
Surface Area |
306.33 Å 2 |
HOMO Energy |
-9.05 ± 0.55 eV |
LUMO Energy |
-1.09 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 2-phenyl-5-benzothiazolepropionic acid
- 3-(2-phenyl-1,3-benzothiazol-5-yl)propionic acid
- 5-benzothiazolepropionic acid, 2-phenyl-
- k 309
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CAS Number(s) |
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InChIKey |
NKOLMUVZDOHNNB-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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