Chemical Properties of 3,18-Dioxo-11«beta»,17«alpha»-dihydroxy-4-etienic acid, 20,18-lactone, 18,11-hemiacetal, MO-TMS

3,18-Dioxo-11«beta»,17«alpha»-dihydroxy-4-etienic acid, 20,18-lactone, 18,11-hemiacetal, MO-TMS

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InChI
InChI=1S/C24H35NO5Si/c1-22-10-8-15(25-27-2)12-14(22)6-7-16-17-9-11-24(30-31(3,4)5)20(26)29-21-23(17,24)13-18(28-21)19(16)22/h12,16-19,21H,6-11,13H2,1-5H3/t16?,17-,18-,19+,21?,22-,23-,24-/m1/s1
InChI Key
LQJQOUIZYIXVAJ-BSDYKZPCSA-N
Formula
C24H35NO5Si
SMILES
CON=C1C=C2CCC3C(C4CC56C(OC(=O)C5(O[Si](C)(C)C)CCC36)O4)C2(C)CC1
Molecular Weight1
445.62
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Physical Properties

Property Value Unit Source
ω 0.6918 Relay (... Calculated Property
ΔfG° -153.85 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -794.15 kJ/mol Relay (... Calculated Property
ΔvapH° 120.11 kJ/mol Relay (... Calculated Property
IE 8.48 eV Relay (... Calculated Property
log10WS -4.40 Relay (... Calculated Property
logPoct/wat 4.414 Crippen Calculated Property
Pc 345.64 kPa Relay (... Calculated Property ⚠️
Inp 3188.00 NIST
Tboil 678.33 K Relay (... Calculated Property
Tc 1002.40 K Relay (... Calculated Property
Tfus 430.33 K Relay (... Calculated Property
Vc 1.297 m3/kmol Relay (... Calculated Property

Similar Compounds

azadirachtin. 5,6-Dihydrouracil riboside, TMS. O-Acetylcrotavernine. 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 3,18-Dioxo-11«beta»,17«alpha»-dihydroxy-4-etienic acid, 20,18-lactone, 18,11-hemiacetal, MO-TMS.

Sources

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