Chemical Properties of Delta 1(2)-alpha- naphthalenemalonic acid, 3-hydroxy-4-oxo-, diethyl ester (CAS 7475-39-0)

Delta 1(2)-alpha- naphthalenemalonic acid, 3-hydroxy-4-oxo-, diethyl ester

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InChI
InChI=1S/C17H16O6/c1-3-22-16(20)14(17(21)23-4-2)12-9-13(18)15(19)11-8-6-5-7-10(11)12/h5-9,18H,3-4H2,1-2H3
InChI Key
NOYJQYUJKVGDGF-UHFFFAOYSA-N
Formula
C17H16O6
SMILES
CCOC(=O)C(C(=O)OCC)=C1C=C(O)C(=O)c2ccccc21
Molecular Weight1
316.31
CAS
7475-39-0
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Physical Properties

Property Value Unit Source
ΔfG° -418.61 kJ/mol Joback Calculated Property
ΔfH°gas -749.15 kJ/mol Joback Calculated Property
ΔfusH° 37.42 kJ/mol Joback Calculated Property
ΔvapH° 97.83 kJ/mol Joback Calculated Property
log10WS -3.18 Crippen Calculated Property
logPoct/wat 2.205 Crippen Calculated Property
McVol 229.490 ml/mol McGowan Calculated Property
Pc 2329.27 kPa Joback Calculated Property
Tboil 958.94 K Joback Calculated Property
Tc 1186.99 K Joback Calculated Property
Tfus 621.99 K Joback Calculated Property
Vc 0.874 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [703.60; 744.42] J/mol×K [958.94; 1186.99] Show Hide
Cp,gas 703.60 J/mol×K 958.94 Joback Calculated Property
Cp,gas 713.19 J/mol×K 996.95 Joback Calculated Property
Cp,gas 721.65 J/mol×K 1034.96 Joback Calculated Property
Cp,gas 728.98 J/mol×K 1072.96 Joback Calculated Property
Cp,gas 735.22 J/mol×K 1110.97 Joback Calculated Property
Cp,gas 740.36 J/mol×K 1148.98 Joback Calculated Property
Cp,gas 744.42 J/mol×K 1186.99 Joback Calculated Property

Similar Compounds

Metergoline. 1-Methyl-6«alpha»,7«alpha»-dihydroxyestrone, TMS. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. norbormide. ethyl eburnamenine-14-carboxylate. cis-1,2-Indanediol, ferrocenylboronate. Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Codeine-propionyl. Ajmaline. Galantamin. 3-propionyl-morphine.

Find more compounds similar to Delta 1(2)-alpha- naphthalenemalonic acid, 3-hydroxy-4-oxo-, diethyl ester.

Sources

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