Chemical Properties of N-Desmethyl mianserin (CAS 71936-92-0)

N-Desmethyl mianserin

InChI
InChI=1S/C17H18N2/c1-3-7-15-13(5-1)11-14-6-2-4-8-16(14)19-10-9-18-12-17(15)19/h1-8,17-18H,9-12H2
InChI Key
ZBILSSSEXRZGKS-UHFFFAOYSA-N
Formula
C17H18N2
SMILES
c1ccc2c(c1)Cc1ccccc1N1CCNCC21
Molecular Weight1
250.34
CAS
71936-92-0
Other Names
  • Desmethylmianserin
  • Normianserine
  • Dibenzo[c,f]pyrazino[1,2-a]azepine, 1,2,3,4,10,14b-hexahydro-
  • (±)-1,2,3,4,10,14b-Hexahydro-dibenzo[c,f]pyrazino[1,2-a]azepine
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Physical Properties

Property Value Unit Source
ω 0.5429 Relay (1.0) Calculated Property
ΔfG° 421.45 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 298.98 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 112.24 kJ/mol Relay (1.0) Calculated Property
IE 7.71 eV Relay (1.0) Calculated Property
log10WS -2.82 Relay (1.0) Calculated Property
logPoct/wat 2.742 Crippen Calculated Property
McVol 201.110 ml/mol McGowan Calculated Property
Pc 2582.45 kPa Relay (1.0-beta) Calculated Property
Tboil 693.17 K Relay (1.0) Calculated Property
Tc 979.49 K Relay (1.0) Calculated Property
Tfus 407.12 K Relay (1.0) Calculated Property
Vc 0.716 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Mianserin. 2-Methyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cyclohepten-7-ol, acetate. 2-Acetyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cyclohepten-7-ol, acetate (ester). 2-Acetyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cycloheptene. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5«alpha»)-. Oxymorphone. Oxycodone, trimethylsilyl ether. Oxymorphone, bis(trimethylsilyl) ether. Naloxone, bis(trimethylsilyl) ether. Oxycodone. Oxycodone TMS derivative. Naloxone. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Naltrexone.

Find more compounds similar to N-Desmethyl mianserin.

Sources

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