Chemical Properties of OXYPHENISATIN ACETATE

OXYPHENISATIN ACETATE

InChI
InChI=1S/C24H19NO5/c1-15(26)29-19-11-7-17(8-12-19)24(18-9-13-20(14-10-18)30-16(2)27)21-5-3-4-6-22(21)25-23(24)28/h3-14H,1-2H3,(H,25,28)
InChI Key
PHPUXYRXPHEJDF-UHFFFAOYSA-N
Formula
C24H19NO5
SMILES
CC(=O)Oc1ccc(C2(c3ccc(OC(C)=O)cc3)C(=O)Nc3ccccc32)cc1
Molecular Weight1
401.42
Other Names
  • 2-Indolinone, 3,3-bis(p-hydroxyphenyl)-, diacetate (ester)
  • 2H-Indol-2-one, 3,3-bis[4-(acetyloxy)phenyl]-1,3-dihydro-
  • 3,3-Bis(4-acetoxyphenyl)oxindole
  • 3,3-Bis(p-acetoxyphenyl)-2-indolinone
  • 3,3-Bis(p-acetoxyphenyl)oxindole
  • 3,3-Bis(p-hydroxyphenyl)-2-indolinone diacetate
  • 3,3-Bis(p-hydroxyphenyl)-2-indolinone diacetate (ester)
  • 3,3-Bis[4-(acetyloxy)phenyl]-1,3-dihydro-2H-indol-2-one
  • 4,4'-Diacetoxydiphenylisatin
  • Acelax
  • Acetalax
  • Acetophenolisatin
  • Acetphenolisatin
  • Bisatin
  • Brocatine
  • Bydolax
  • Cirotyl
  • Contax
  • Darmoletten
  • Diacetoxydiphenylisatin
  • Diacetyl bis(hydroxyphenyl)isatin
  • Diacetyl bis(p-hydroxyphenyl)isatin
  • Diacetyldihydroxydiphenylisatin
  • Diacetyldioxyphenylisatin
  • Diacetyldiphenolisatin
  • Diphesatin
  • Diphesatine
  • Eulaxin
  • Isacen
  • Isaphen
  • Isaphenin
  • Isatin, O,O'-diacetyldiphenol-
  • Isocrin
  • Izafenin
  • LA 96
  • Lavema
  • Laxo-Isatin
  • Laxocol
  • Lenavac
  • Lisagal
  • NSC 117186
  • NSC-59687
  • Oxindole, 3,3'-bis(p-hydroxyphenyl)-, diacetate
  • Promassolax
  • Prulet
  • Prulet Liquitab
  • Puragaceen
  • Purgaceen
  • Purgophen
  • Sanapert
  • Tete-Lax
  • oxyphenisatine di(acetate)
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Physical Properties

Property Value Unit Source
ΔfH°gas -529.76 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 48.55 kJ/mol Joback Calculated Property
ΔvapH° 126.61 kJ/mol Relay (1.0) Calculated Property
IE 7.51 eV Relay (1.0) Calculated Property
logPoct/wat 3.824 Crippen Calculated Property
McVol 293.310 ml/mol McGowan Calculated Property
Tboil 726.16 K Relay (1.0) Calculated Property
Tfus [515.15; 524.00] K Show Hide
Tfus 515.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Tfus 524.00 ± 3.00 K NIST
Tfus 516.00 ± 8.00 K NIST

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [379.28; 926.45] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-7.38100e+01
Coefficient B2.02014e+00
Coefficient C-1.43328e-03
Coefficient D4.13400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 379.28 J/mol×K 273.00 Calculated Property
Cp,gas 479.79 J/mol×K 353.78 Calculated Property
Cp,gas 567.32 J/mol×K 434.56 Calculated Property
Cp,gas 643.18 J/mol×K 515.33 Calculated Property
Cp,gas 708.67 J/mol×K 596.11 Calculated Property
Cp,gas 765.11 J/mol×K 676.89 Calculated Property
Cp,gas 813.80 J/mol×K 757.67 Calculated Property
Cp,gas 856.05 J/mol×K 838.44 Calculated Property
Cp,gas 893.16 J/mol×K 919.22 Calculated Property
Cp,gas 926.45 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Phenyloxindole. 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). MIANSERIN. Spiro[2H-1-benzopyran-2,2'-[2H]indole], 1',3'-dihydro-1',3',3'-trimethyl-6-nitro-. Nomifemsine M(HO), diacetylated, isomer # 2. 2-Acetyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cycloheptene. cis-1,2-Tetralinediol, ferrocenylboronate. [6-[6-[[4-acetyloxy-10-hydroxy-5-methoxy-9,16-dimethyl-2-oxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-6-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl] 3-methylbutanoate. Nalmefene, bis(trifluoroacetate). Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-acetyl. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. 1,2,3,4-Tetrahydroanthracene-cis-1,2-diol, ferrocenylboronate. Butorphanol di-TMS derivative. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-acetyl.

Find more compounds similar to OXYPHENISATIN ACETATE.

Sources

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