Chemical Properties of (1R,9S)-1-Acetoxy-N-acetyl-1,9-dihydro-anhydronornarceine

(1R,9S)-1-Acetoxy-N-acetyl-1,9-dihydro-anhydronornarceine

InChI
InChI=1S/C25H27NO10/c1-13(27)26-9-8-15-10-18-22(35-12-34-18)23(33-5)20(15)25(26,36-14(2)28)11-16-6-7-17(31-3)21(32-4)19(16)24(29)30/h6-7,10H,8-9,11-12H2,1-5H3,(H,29,30)/t25-/m1/s1
InChI Key
JYLSYDBZXRABOF-RUZDIDTESA-N
Formula
C25H27NO10
SMILES
COc1ccc(CC2(OC(C)=O)c3c(cc4c(c3OC)OCO4)CCN2C(C)=O)c(C(=O)O)c1OC
Molecular Weight1
501.48
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ω 1.3249 Relay (1.0) Calculated Property
ΔfG° -755.79 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -1384.67 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 148.65 kJ/mol Relay (1.0) Calculated Property
IE 7.49 eV Relay (1.0) Calculated Property
log10WS -3.45 Relay (1.0) Calculated Property
logPoct/wat 2.502 Crippen Calculated Property
McVol 349.650 ml/mol McGowan Calculated Property
Pc 674.93 kPa Relay (1.0-beta) Calculated Property
Inp 3848.00 NIST
Tboil 758.76 K Relay (1.0) Calculated Property
Tc 1131.46 K Relay (1.0) Calculated Property
Tfus 453.46 K Relay (1.0) Calculated Property
Vc 1.295 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Codeine-propionyl. Nalmefene. Normorphine, N-trimethylsilyl-, bis(trimethylsilyl) ether. Ajmaline. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. Strychnine. Normorphine TMS. acetylepibaptifoline. Neopine. Galantamin. Deserpidine. [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. 3-O,6-O,N-Triacetylnormorphine. Thymidine, 3'-O-acetyl, 5'-O-cyclotetramethylene-tertbutylsilyl.

Find more compounds similar to (1R,9S)-1-Acetoxy-N-acetyl-1,9-dihydro-anhydronornarceine.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.