| Formula |
C12H15NO2S |
| IUPAC Name |
2-[3-(o-tolyl)propanoylamino]ethanethioic s-acid |
| Molecular Mass |
237.318 g·mol−1 |
| Heat of Formation |
-314.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.60 ± 1.08 D |
| Volume |
288.83 Å 3 |
| Surface Area |
276.72 Å 2 |
| HOMO Energy |
-9.40 ± 0.55 eV |
| LUMO Energy |
-1.27 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[3-(2-methylphenyl)propanoylamino]ethanethioic s-acid
- 2-[3-(2-methylphenyl)propanoylamino]thioacetic acid
- 2-[[3-(2-methylphenyl)-1-oxopropyl]amino]ethanethioic s-acid
- ethanethioic acid, ((1-oxo-3-phenylpropyl)amino)-, o-methyl ester
- n-(3-phenylpropionyl)glycine methylthio ester
- n-(beta-phenylpropionyl)glycine methylthio ester
- nppgmte
- o-methyl ((1-oxo-3-phenylpropyl)amino)ethanethioate
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| CAS Number(s) |
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| InChIKey |
VBUPPTSZSYEBML-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
N
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