Chemical Properties of Hydroxy-N-methylcytisine

Hydroxy-N-methylcytisine

InChI
InChI=1S/C12H16N2O2/c1-13-6-8-5-9(7-13)12(16)14-10(8)3-2-4-11(14)15/h2-4,8-9,12,16H,5-7H2,1H3
InChI Key
XEYCQYZMQKENBX-UHFFFAOYSA-N
Formula
C12H16N2O2
SMILES
CN1CC2CC(C1)C(O)n1c2cccc1=O
Molecular Weight1
220.27
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Physical Properties

Property Value Unit Source
ω 0.6492 Relay (1.0) Calculated Property
ΔfG° 56.20 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -283.24 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 118.78 kJ/mol Relay (1.0) Calculated Property
IE 8.04 eV Relay (1.0) Calculated Property
log10WS -0.11 Relay (1.0) Calculated Property
logPoct/wat 0.388 Crippen Calculated Property
McVol 166.160 ml/mol McGowan Calculated Property
Pc 2795.25 kPa Relay (1.0-beta) Calculated Property
Inp 2217.00 NIST
Tboil 621.27 K Relay (1.0) Calculated Property
Tc 886.93 K Relay (1.0) Calculated Property
Tfus 448.26 K Relay (1.0) Calculated Property
Vc 0.617 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Nalmefene. 3-propionyl-morphine. Strychnine. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. Brucine. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). 3-O,6-O,N-Triacetylnormorphine. 6-O,N-Diacetylnorcodeine. N6-(cyclotetramethylene-tertbutylsilyl)-Adenosine, 2',3',5'-tris-O-TBDMS. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. TCN. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. Benzylmorphine.

Find more compounds similar to Hydroxy-N-methylcytisine.

Sources

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