Formula |
C22H31NO3 |
IUPAC Name |
4-(diethylamino)but-2-ynyl (2s)-2-cyclohexyl-2-hydroxy-2-phenyl-acetate |
Molecular Mass |
357.486 g·mol−1 |
Heat of Formation |
-349.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.98 ± 1.08 D |
Volume |
472.8 Å 3 |
Surface Area |
377.38 Å 2 |
HOMO Energy |
-8.95 ± 0.55 eV |
LUMO Energy |
0.04 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid 4-diethylaminobut-2-ynyl ester
- (2s)-2-cyclohexyl-2-hydroxy-2-phenylacetic acid 4-diethylaminobut-2-ynyl ester
- 4-diethylaminobut-2-ynyl (2s)-2-cyclohexyl-2-hydroxy-2-phenyl-acetate
- 4-diethylaminobut-2-ynyl (2s)-2-cyclohexyl-2-hydroxy-2-phenyl-ethanoate
- 4-diethylaminobut-2-ynyl (2s)-2-cyclohexyl-2-hydroxy-2-phenylacetate
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InChIKey |
XIQVNETUBQGFHX-JOCHJYFZSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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