Chemical Properties of Pellotine (CAS 83-14-7)

Pellotine

InChI
InChI=1S/C13H19NO3/c1-8-11-9(5-6-14(8)2)7-10(16-3)13(17-4)12(11)15/h7-8,15H,5-6H2,1-4H3
InChI Key
NKHMWHLJHODBEP-UHFFFAOYSA-N
Formula
C13H19NO3
SMILES
COc1cc2c(c(O)c1OC)C(C)N(C)CC2
Molecular Weight1
237.29
CAS
83-14-7
Other Names
  • Methylanhalonidine
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 0.7207 Relay (1.0) Calculated Property
Δf -94.16 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas -364.68 kJ/mol Relay (1.0) Calculated Property
Δvap 96.97 kJ/mol Relay (1.0) Calculated Property
IE 7.52 eV Relay (1.0) Calculated Property
log10WS -0.92 Relay (1.0) Calculated Property
logPoct/wat 1.958 Crippen Calculated Property
McVol 187.000 ml/mol McGowan Calculated Property
Pc 2676.58 kPa Relay (1.0-beta) Calculated Property
Inp [1800.00; 1825.00]   Show Hide
Inp 1800.00 NIST
Inp 1825.00 NIST
Inp 1800.00 NIST
Tboil 587.86 K Relay (1.0) Calculated Property
Tc 831.79 K Relay (1.0) Calculated Property
Tfus 402.54 K Relay (1.0) Calculated Property
Vc 0.674 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Lophophorine. Anhalonidine. 6H-Dibenzo[a,g]quinolizine-2,9-diol, 5,8,13,13a-tetrahydro-3,10-dimethoxy-, (.+/-.)-. Oxycodone. Oxymorphone. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5«alpha»)-. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. Oxycodone, trimethylsilyl ether. Oxycodone TMS derivative. 5,6-Dihydrouracil riboside, TMS. Naltrexone. N-Desmethylmirtazapine. Naloxone, bis(trimethylsilyl) ether. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Oxymorphone, bis(trimethylsilyl) ether.

Find more compounds similar to Pellotine.

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.