Chemical Properties of 11-Dehydroestrone (enol), TMS

11-Dehydroestrone (enol), TMS

InChI
InChI=1S/C24H36O2Si2/c1-24-15-14-20-19-11-9-18(25-27(2,3)4)16-17(19)8-10-21(20)22(24)12-13-23(24)26-28(5,6)7/h9,11,13-16,20-22H,8,10,12H2,1-7H3/t20?,21?,22?,24-/m1/s1
InChI Key
RTPDSJWDENKOGH-XRCKSUEFSA-N
Formula
C24H36O2Si2
SMILES
CC12C=CC3c4ccc(O[Si](C)(C)C)cc4CCC3C1CC=C2O[Si](C)(C)C
Molecular Weight1
412.71
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Physical Properties

Property Value Unit Source
ω 0.6145 Relay (1.0) Calculated Property
ΔfG° 158.01 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -472.94 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 100.30 kJ/mol Relay (1.0) Calculated Property
IE 7.87 eV Relay (1.0) Calculated Property
log10WS -6.15 Relay (1.0) Calculated Property
logPoct/wat 6.878 Crippen Calculated Property
Pc 294.80 kPa Relay (1.0-beta) Calculated Property
Inp [2783.00; 2783.00]   Show Hide
Inp 2783.00 NIST
Inp 2783.00 NIST
Tboil 664.47 K Relay (1.0) Calculated Property
Tc 909.70 K Relay (1.0) Calculated Property
Tfus 381.21 K Relay (1.0) Calculated Property
Vc 1.291 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Nalmefene. Strychnine. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

Find more compounds similar to 11-Dehydroestrone (enol), TMS.

Sources

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