| Formula |
C20H23ClO2 |
| IUPAC Name |
(8s,13s,14s,17s)-17-(2-chloroethynyl)-17-hydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one |
| Molecular Mass |
330.848 g·mol−1 |
| Heat of Formation |
-141.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.43 ± 1.08 D |
| Volume |
395.14 Å 3 |
| Surface Area |
326.44 Å 2 |
| HOMO Energy |
-9.24 ± 0.55 eV |
| LUMO Energy |
-0.41 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (8s,13s,14s,17s)-17-(2-chloroethynyl)-17-hydroxy-13-methyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
- d04093
- ethynerone (usan)
|
| InChIKey |
KEOBKPHJNAILCW-FUMNGEBKSA-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
Cl
|
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