| Formula |
C12H15NO3S |
| IUPAC Name |
(2r)-2-acetamido-3-benzylsulfanyl-propanoic acid |
| Molecular Mass |
253.317 g·mol−1 |
| Heat of Formation |
-514.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.71 ± 1.08 D |
| Volume |
301.02 Å 3 |
| Surface Area |
257.36 Å 2 |
| HOMO Energy |
-8.87 ± 0.55 eV |
| LUMO Energy |
-0.59 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2r)-2-acetamido-3-(benzylthio)propionic acid
- (2r)-2-acetamido-3-(phenylmethylsulfanyl)propanoic acid
- (2r)-2-acetamido-3-(phenylmethylthio)propanoic acid
- n-acetyl-s-benzyl-l-cysteine
- s-benzyl-n-acetyl-l-cysteine
- s-benzylmercapturic acid
- sbnac
|
| CAS Number(s) |
|
| InChIKey |
BJUXDERNWYKSIQ-NSHDSACASA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
N
|
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