Chemical Properties of cyclomegistine

cyclomegistine

InChI
InChI=1S/C18H21NO7/c1-19-11-9-7-6-8-10(11)13(20)12-14(19)18(26-5,16(22)24-3)17(12,25-4)15(21)23-2/h6-9,12,14H,1-5H3/t12?,14?,17-,18+/m1/s1
InChI Key
KNMICIOSHLUGSP-VQHUDLGKSA-N
Formula
C18H21NO7
SMILES
COC(=O)C1(OC)C2C(=O)c3ccccc3N(C)C2C1(OC)C(=O)OC
Molecular Weight1
363.36
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Physical Properties

Property Value Unit Source
ω 0.6901 Relay (1.0) Calculated Property
Δf -569.59 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas -941.15 kJ/mol Relay (1.0) Calculated Property
Δvap 112.03 kJ/mol Relay (1.0) Calculated Property
IE 7.89 eV Relay (1.0) Calculated Property
log10WS -2.07 Relay (1.0) Calculated Property
logPoct/wat 0.434 Crippen Calculated Property
McVol 257.170 ml/mol McGowan Calculated Property
Pc 1635.68 kPa Relay (1.0-beta) Calculated Property
Inp 2736.00 NIST
Tboil 640.78 K Relay (1.0) Calculated Property
Tc 949.90 K Relay (1.0) Calculated Property
Tfus 376.56 K Relay (1.0) Calculated Property
Vc 0.915 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Nalmefene. Ajmaline. Strychnine. Normorphine, N-trimethylsilyl-, bis(trimethylsilyl) ether. Galantamin. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. 3-O,6-O,N-Triacetylnormorphine. Xanthine riboside, TMS. acetylepibaptifoline. Hydromorphone, trimethylsilyl ether. 3-propionyl-morphine. Paclitaxel. [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»)-. Dihydroergokryptine. Benzylmorphine.

Find more compounds similar to cyclomegistine.

Sources

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