Chemical Properties of Ethaneperoxoic acid, 1-cyano-1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]pentyl ester

Ethaneperoxoic acid, 1-cyano-1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]pentyl ester

InChI
InChI=1S/C19H25NO5/c1-3-4-10-18(15-20,25-24-16(2)21)11-12-19(22-13-14-23-19)17-8-6-5-7-9-17/h5-9H,3-4,10-14H2,1-2H3
InChI Key
XBNHWTBTLQIXHU-UHFFFAOYSA-N
Formula
C19H25NO5
SMILES
CCCCC(C#N)(CCC1(c2ccccc2)OCCO1)OOC(C)=O
Molecular Weight1
347.41
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Physical Properties

Property Value Unit Source
ΔfusH° 42.25 kJ/mol Joback Calculated Property
logPoct/wat 3.614 Crippen Calculated Property
McVol 270.380 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [876.87; 974.11] J/mol×K [909.91; 1141.17] Show Hide
Cp,gas 876.87 J/mol×K 909.91 Joback Calculated Property
Cp,gas 893.57 J/mol×K 948.45 Joback Calculated Property
Cp,gas 909.83 J/mol×K 987.00 Joback Calculated Property
Cp,gas 925.84 J/mol×K 1025.54 Joback Calculated Property
Cp,gas 941.78 J/mol×K 1064.09 Joback Calculated Property
Cp,gas 957.81 J/mol×K 1102.63 Joback Calculated Property
Cp,gas 974.11 J/mol×K 1141.17 Joback Calculated Property

Similar Compounds

Uridine, 2'-O-acetyl, 3',5'-bis-O-TBDMS. Noscapine. Uridine, 2'-O-TBDMS, 3',5'-bis-O-acetyl. 1,2,3,4-Tetrahydroanthracene-cis-1,2-diol, ferrocenylboronate. Uridine, 2',3'-bis-O-acetyl, 5'-O-TBDMS. N-Desmethylmirtazapine. Butorphanol di-TMS derivative. Uridine, 2'-O-TBDMS, 3'-O-acetyl, 5'-O-TBDMS. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. cis-1,2-Tetralinediol, ferrocenylboronate. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. Hydrastine. Xanthine riboside, TMS. Pholcodine. ERGOTAMINE.

Find more compounds similar to Ethaneperoxoic acid, 1-cyano-1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]pentyl ester.

Sources

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