Chemical Properties of Inabenfide, tert-butyldimethylsilyl ether

Inabenfide, tert-butyldimethylsilyl ether

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InChI
InChI=1S/C25H29ClN2O2Si/c1-25(2,3)31(4,5)30-23(18-9-7-6-8-10-18)21-17-20(26)11-12-22(21)28-24(29)19-13-15-27-16-14-19/h6-17,23H,1-5H3,(H,28,29)
InChI Key
RVDUDBQZXVNDBL-UHFFFAOYSA-N
Formula
C25H29ClN2O2Si
SMILES
CC(C)(C)[Si](C)(C)OC(c1ccccc1)c1cc(Cl)ccc1NC(=O)c1ccncc1
Molecular Weight1
453.05
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Physical Properties

Property Value Unit Source
ω 0.8176 Relay (... Calculated Property
ΔfG° 260.03 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -236.03 kJ/mol Relay (... Calculated Property
ΔvapH° 125.97 kJ/mol Relay (... Calculated Property
IE 8.41 eV Relay (... Calculated Property
log10WS -5.17 Relay (... Calculated Property
logPoct/wat 7.098 Crippen Calculated Property
Pc 1366.48 kPa Relay (... Calculated Property ⚠️
Inp 3000.30 NIST
Tboil 712.40 K Relay (... Calculated Property
Tc 1090.94 K Relay (... Calculated Property
Tfus 425.28 K Relay (... Calculated Property
Vc 1.245 m3/kmol Relay (... Calculated Property

Similar Compounds

Inabenfide, trimethylsilyl ether. Hydroxy-N-methylcytisine. Inabenfide, N,O-bis(tert-butyldimethylsilyl)-. 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 Inabenfide, tert-butyldimethylsilyl ether.

Sources

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