Chemical Properties of Octaethyl-porphyrin, Si-(OTBDMS)2-derivative

Octaethyl-porphyrin, Si-(OTBDMS)2-derivative

InChI
InChI=1S/C48H74N4O2Si3/c1-19-31-32(20-2)40-28-44-37(25-7)38(26-8)46-30-42-34(22-4)33(21-3)41(50-42)29-45-36(24-6)35(23-5)43(27-39(31)49-40)51(45)57(52(44)46,53-55(15,16)47(9,10)11)54-56(17,18)48(12,13)14/h27-30H,19-26H2,1-18H3/b39-27-,40-28-,41-29-,42-30-,43-27-,44-28-,45-29-,46-30-
InChI Key
DEMVBRZYNLPFAO-AQXATVBXSA-N
Formula
C48H74N4O2Si3
SMILES
CCC1=C(CC)C2=NC1=Cc1c(CC)c(CC)c3n1[Si](O[Si](C)(C)C(C)(C)C)(O[Si](C)(C)C(C)(C)C)n1c(c(CC)c(CC)c1=CC1=NC(=C3)C(CC)=C1CC)=C2
Molecular Weight1
823.38
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Physical Properties

Property Value Unit Source
ω 1.3145 Relay (1.0) Calculated Property
ΔfG° 497.37 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -561.22 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 141.29 kJ/mol Relay (1.0) Calculated Property
IE 5.79 eV Relay (1.0) Calculated Property
log10WS -10.33 Relay (1.0) Calculated Property
logPoct/wat 11.827 Crippen Calculated Property
Pc -1820.72 kPa Relay (1.0-beta) Calculated Property
Inp 3835.00 NIST
Tboil 853.66 K Relay (1.0) Calculated Property
Tc 1275.30 K Relay (1.0) Calculated Property
Tfus 472.72 K Relay (1.0) Calculated Property
Vc 2.613 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Zinc octaethylporphyrin chloride. 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 Octaethyl-porphyrin, Si-(OTBDMS)2-derivative.

Sources

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