Chemical Properties of 4-Morpholino-6-methyl-1,3,3a,7-tetrazaindene (CAS 78666-95-2)

4-Morpholino-6-methyl-1,3,3a,7-tetrazaindene

InChI
InChI=1S/C10H13N5O/c1-8-6-9(14-2-4-16-5-3-14)15-10(13-8)11-7-12-15/h6-7H,2-5H2,1H3
InChI Key
WFXJTKDSWVTSJP-UHFFFAOYSA-N
Formula
C10H13N5O
SMILES
Cc1cc(N2CCOCC2)n2ncnc2n1
Molecular Weight1
219.24
CAS
78666-95-2
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Physical Properties

Property Value Unit Source
ω 0.5976 Relay (1.0) Calculated Property
ΔfG° 390.13 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 189.01 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 96.99 kJ/mol Relay (1.0) Calculated Property
IE 8.20 eV Relay (1.0) Calculated Property
log10WS -1.80 Relay (1.0) Calculated Property
logPoct/wat 0.269 Crippen Calculated Property
McVol 157.750 ml/mol McGowan Calculated Property
Pc 3913.43 kPa Relay (1.0-beta) Calculated Property
Tboil 636.36 K Relay (1.0) Calculated Property
Tc 930.20 K Relay (1.0) Calculated Property
Tfus 409.91 K Relay (1.0) Calculated Property
Vc 0.606 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

N-beta-hydroxyethyl-n,n'-bis-(4-(6-methyl)-1,3,3a,7-tetrazaindenyl)ethylenediamine. Galathan, 1,2,3,12,15,16-hexadehydro-9,10-[methylenebis(oxy)]-. Metopon. [2H5]trans-Zeatin riboside, permethylated. cis-Zeatin riboside, permethylated. Oxymorphone, bis(trimethylsilyl) ether. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. 5'-S-Methyl-5'-thioadenosine, O,O'-bis(trifluoroacetyl)-. Retroisosenine. Oxycodone. Oxymorphone. Naloxone, bis(trimethylsilyl) ether. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. ethyl eburnamenine-14-carboxylate. Naloxone.

Find more compounds similar to 4-Morpholino-6-methyl-1,3,3a,7-tetrazaindene.

Sources

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