| Formula |
C13H17NO3S |
| IUPAC Name |
(2r)-2-acetamido-3-(o-tolylmethylsulfanyl)propanoic acid |
| Molecular Mass |
267.344 g·mol−1 |
| Heat of Formation |
-559.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.37 ± 1.08 D |
| Volume |
321.48 Å 3 |
| Surface Area |
263.87 Å 2 |
| HOMO Energy |
-8.78 ± 0.55 eV |
| LUMO Energy |
-0.26 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2r)-2-acetamido-3-[(2-methylbenzyl)thio]propionic acid
- (2r)-2-acetamido-3-[(2-methylphenyl)methylsulfanyl]propanoic acid
- (2r)-2-acetamido-3-[(2-methylphenyl)methylthio]propanoic acid
- s-(2-methylbenzyl)-n-acetylcysteine
- s-ortho-mbac
|
| CAS Number(s) |
|
| InChIKey |
TYMRNCZACFVURC-LBPRGKRZSA-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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