Chemical Properties of 1,2-Ethanediol, 1,2-bis(6-methylpyridyl)- (CAS 6630-20-2)

1,2-Ethanediol, 1,2-bis(6-methylpyridyl)-

InChI
InChI=1S/C14H16N2O2/c1-9-5-3-7-11(15-9)13(17)14(18)12-8-4-6-10(2)16-12/h3-8,13-14,17-18H,1-2H3
InChI Key
BQACYHPDFUQUCV-UHFFFAOYSA-N
Formula
C14H16N2O2
SMILES
Cc1cccc(C(O)C(O)c2cccc(C)n2)n1
Molecular Weight1
244.29
CAS
6630-20-2
Other Names
  • 1,2-bis(6-methyl-2-pyridyl)ethanediol
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Physical Properties

Property Value Unit Source
ω 0.8192 Relay (1.0) Calculated Property
ΔfG° 56.87 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -188.62 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 121.77 kJ/mol Relay (1.0) Calculated Property
IE 8.49 eV Relay (1.0) Calculated Property
log10WS -1.23 Relay (1.0) Calculated Property
logPoct/wat 1.860 Crippen Calculated Property
McVol 192.300 ml/mol McGowan Calculated Property
Pc 2905.94 kPa Relay (1.0-beta) Calculated Property
Tboil 617.64 K Relay (1.0) Calculated Property
Tc 901.62 K Relay (1.0) Calculated Property
Tfus 409.79 K Relay (1.0) Calculated Property
Vc 0.719 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

12-O-Methylcarnosol. Cytosine arabinoside, dimethyl-propyldimethylsilyl derivative. Cytosine arabinoside, methyl-TMS derivative. «alpha»-Pyridoin. Glyceollin V, TMS. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Tetrabenazine M (desmethyl-HO-), monoacetylated. cyclomegistine. norbormide. 1-Methyl-6«alpha»,7«alpha»-dihydroxyestrone, TMS. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. Glyceollin III, TMS. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. 2'-Deoxyguanosine, tris(trimethylsilyl) deriv..

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Sources

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