3,5-Bis(Trifluoromethyl)Benzyl N-Acetyl-L-Tryptophanate
Properties
Property | Value |
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Formula | C22H18F6N2O3 |
IUPAC Name | [3,5-bis(trifluoromethyl)phenyl]methyl (2s)-2-acetamido-3-(1h-indol-3-yl)propanoate |
Molecular Mass | 472.380 g·mol−1 |
Heat of Formation | -1671.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.15 ± 1.08 D |
Volume | 506.76 Å 3 |
Surface Area | 388.4 Å 2 |
HOMO Energy | -8.69 ± 0.55 eV |
LUMO Energy | -1.39 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | BYYQYXVAWXAYQC-IBGZPJMESA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |