Chemical Properties of 1-Carboethoxy-2,3-phthaloylpyrrocoline (CAS 3306-93-2)

1-Carboethoxy-2,3-phthaloylpyrrocoline

InChI
InChI=1S/C19H13NO4/c1-2-24-19(23)14-13-9-5-6-10-20(13)16-15(14)17(21)11-7-3-4-8-12(11)18(16)22/h3-10H,2H2,1H3
InChI Key
RCDIUAFMNCXJRV-UHFFFAOYSA-N
Formula
C19H13NO4
SMILES
CCOC(=O)c1c2c(n3ccccc13)C(=O)c1ccccc1C2=O
Molecular Weight1
319.31
CAS
3306-93-2
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Physical Properties

Property Value Unit Source
ω 0.8258 Relay (1.0) Calculated Property
ΔfG° -187.76 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -339.65 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 111.51 kJ/mol Relay (1.0) Calculated Property
IE 8.12 eV Relay (1.0) Calculated Property
log10WS -5.00 Relay (1.0) Calculated Property
logPoct/wat 2.891 Crippen Calculated Property
McVol 225.590 ml/mol McGowan Calculated Property
Pc 1544.48 kPa Relay (1.0-beta) Calculated Property
Tboil 721.81 K Relay (1.0) Calculated Property
Tc 1069.81 K Relay (1.0) Calculated Property
Tfus 455.43 K Relay (1.0) Calculated Property
Vc 0.856 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

1-Carbomethoxy-2,3-phthaloylpyrrocoline. 1-Phenylcarbamoyl-2,3-phthaloylpyrrocoline. 1-Acetyl-2,3-phthaloylpyrrocoline. 7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. 1-Phenylcarbamoyl-7-styryl-2,3-phthaloylpyrrocoline. Heptafluorobutyryl-codeine. QUINIDINE, M(HO-), AC. Buprenorphine. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate]. Deserpidine. Dihydromorphine , di(trimehylsilyl) ether. Normorphine TMS. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Hydromorphone, trimethylsilyl ether. 3-propionyl-morphine.

Find more compounds similar to 1-Carboethoxy-2,3-phthaloylpyrrocoline.

Sources

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