Chemical Properties of N-formyltetrahydrocytisine

N-formyltetrahydrocytisine

InChI
InChI=1S/C12H18N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h8-11H,1-7H2
InChI Key
YCAYHACOUGYTQJ-UHFFFAOYSA-N
Formula
C12H18N2O2
SMILES
O=CN1CC2CC(C1)C1CCCC(=O)N1C2
Molecular Weight1
222.28
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 0.5303 Relay (1.0) Calculated Property
ΔfG° 56.59 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -383.82 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 94.13 kJ/mol Relay (1.0) Calculated Property
IE 8.40 eV Relay (1.0) Calculated Property
log10WS -1.08 Relay (1.0) Calculated Property
logPoct/wat 0.476 Crippen Calculated Property
McVol 170.460 ml/mol McGowan Calculated Property
Pc 2709.70 kPa Relay (1.0-beta) Calculated Property
Inp 2150.00 NIST
Tboil 628.45 K Relay (1.0) Calculated Property
Tc 919.75 K Relay (1.0) Calculated Property
Tfus 416.37 K Relay (1.0) Calculated Property
Vc 0.612 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Lupanine. 7,14-Methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-4-one, dodecahydro-, [7S-(7«alpha»,7a«alpha»,14«alpha»,14a«alpha»)]-. 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, decahydro-3-methyl-. Matrine. 2,6-Piperidinedione, 1-[(octahydro-2H-quinolizin-1-yl)methyl]-, (1R-cis)-. 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, decahydro-. Tetrahydrorhombifoline. Tetrahydrorhombipholine. 1-[[(1S)-2,3,4,6,7,8,9,9a-Octahydro-1H-quinolizin-1-yl]methyl]pyrrolidine-2,5-dione. 11-AIIylcytisine. 7,14-Methano-4H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocine-4,13(14H)-dione, decahydro-, [7S-(7«alpha»,7a«beta»,14«alpha»,14a«alpha»)]-. Aphylline. 7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-6-one, dodecahydro-, [7R-(7«alpha»,7a«alpha»,14«alpha»,14a«alpha»)]-. 7,14-Methano-2H,6H-dipyrido[1,2-a:1',2'-E][1,5]diazocin-6-one, dodecahydro-, [7R-(7«alpha»,7a«alpha»,14«alpha»,14a«beta»)]-. 11-Oxotetrahydro-rhombifoline.

Find more compounds similar to N-formyltetrahydrocytisine.

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.