Formula |
C13H18N2O2S2 |
IUPAC Name |
(2r)-2-amino-3-(3-phenylpropylcarbamothioylsulfanyl)propanoic acid |
Molecular Mass |
298.424 g·mol−1 |
Heat of Formation |
-269.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.50 ± 1.08 D |
Volume |
357.88 Å 3 |
Surface Area |
282.89 Å 2 |
HOMO Energy |
-8.24 ± 0.55 eV |
LUMO Energy |
-0.65 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-2-amino-3-(3-phenylpropylcarbamothioylsulfanyl)propanoic acid
- (2r)-2-amino-3-(3-phenylpropylthiocarbamoylthio)propionic acid
- (2r)-2-amino-3-[[(3-phenylpropylamino)-thioxomethyl]thio]propanoic acid
- l-cysteine, (3-phenylpropyl)carbamodithioate (ester)
- pptc-cysteine
- s-(n-(3-phenylpropyl)(thiocarbamoyl))-cysteine
- s-(n-(3-phenylpropyl)(thiocarbamoyl))-l-cysteine
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CAS Number(s) |
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InChIKey |
XMEUXBMTQJJHED-NSHDSACASA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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