Chemical Properties of Ethaneperoxoic acid, 1-cyano-1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]pentyl ester (CAS 58422-92-7)

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

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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
CAS
58422-92-7
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Physical Properties

Property Value Unit Source
ΔfG° -122.57 kJ/mol Joback Calculated Property
ΔfH°gas -608.13 kJ/mol Joback Calculated Property
ΔfusH° 40.67 kJ/mol Joback Calculated Property
ΔvapH° 89.04 kJ/mol Joback Calculated Property
log10WS -4.53 Crippen Calculated Property
logPoct/wat 3.614 Crippen Calculated Property
McVol 270.380 ml/mol McGowan Calculated Property
Pc 1624.60 kPa Joback Calculated Property
Tboil 927.78 K Joback Calculated Property
Tc 1160.93 K Joback Calculated Property
Tfus 580.05 K Joback Calculated Property
Vc 1.030 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [883.19; 984.58] J/mol×K [927.78; 1160.93] Show Hide
Cp,gas 883.19 J/mol×K 927.78 Joback Calculated Property
Cp,gas 900.26 J/mol×K 966.64 Joback Calculated Property
Cp,gas 917.02 J/mol×K 1005.50 Joback Calculated Property
Cp,gas 933.66 J/mol×K 1044.35 Joback Calculated Property
Cp,gas 950.35 J/mol×K 1083.21 Joback Calculated Property
Cp,gas 967.26 J/mol×K 1122.07 Joback Calculated Property
Cp,gas 984.58 J/mol×K 1160.93 Joback Calculated Property

Similar Compounds

Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. Uridine, 2'-O-acetyl, 3',5'-bis-O-TBDMS. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. cis-1,2-Tetralinediol, ferrocenylboronate. 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. Noscapine. N-Desmethylmirtazapine. Butorphanol di-TMS derivative. Hydrastine. Uridine, 2'-O-TBDMS, 3'-O-acetyl, 5'-O-TBDMS. QUINIDINE, M(HO-), AC. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate]. Dihydrocodeine TMS derivative.

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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