Chemical Properties of Succinic acid, 3-bromophenethyl isobutyl ester

Succinic acid, 3-bromophenethyl isobutyl ester

InChI
InChI=1S/C16H21BrO4/c1-12(2)11-21-16(19)7-6-15(18)20-9-8-13-4-3-5-14(17)10-13/h3-5,10,12H,6-9,11H2,1-2H3
InChI Key
YFWZSEBVYTXVRS-UHFFFAOYSA-N
Formula
C16H21BrO4
SMILES
CC(C)COC(=O)CCC(=O)OCCc1cccc(Br)c1
Molecular Weight1
357.24
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Physical Properties

Property Value Unit Source
ΔfusH° 41.35 kJ/mol Joback Calculated Property
logPoct/wat 3.514 Crippen Calculated Property
McVol 244.920 ml/mol McGowan Calculated Property
Pc 1809.23 kPa Joback Calculated Property
Inp [2290.00; 2290.00]   Show Hide
Inp 2290.00 NIST
Inp 2290.00 NIST
Tboil 641.43 K Relay (1.0) Calculated Property
Tc 826.98 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [678.94; 746.85] J/mol×K [779.50; 990.41] Show Hide
Cp,gas 678.94 J/mol×K 779.50 Joback Calculated Property
Cp,gas 692.98 J/mol×K 814.65 Joback Calculated Property
Cp,gas 705.89 J/mol×K 849.80 Joback Calculated Property
Cp,gas 717.71 J/mol×K 884.95 Joback Calculated Property
Cp,gas 728.46 J/mol×K 920.10 Joback Calculated Property
Cp,gas 738.16 J/mol×K 955.26 Joback Calculated Property
Cp,gas 746.85 J/mol×K 990.41 Joback Calculated Property
η [0.0000554; 0.0010007] Pa×s [438.48; 779.50] Show Hide
η 0.0010007 Pa×s 438.48 Joback Calculated Property
η 0.0004683 Pa×s 495.32 Joback Calculated Property
η 0.0002563 Pa×s 552.15 Joback Calculated Property
η 0.0001569 Pa×s 608.99 Joback Calculated Property
η 0.0001045 Pa×s 665.83 Joback Calculated Property
η 0.0000742 Pa×s 722.66 Joback Calculated Property
η 0.0000554 Pa×s 779.50 Joback Calculated Property

Similar Compounds

Succinic acid, 3-bromophenethyl propyl ester. Succinic acid, 3-bromophenethyl butyl ester. Succinic acid, di(3-bromophenethyl) ester. Glutaric acid, 2-(3-bromophenyl)ethyl isobutyl ester. Succinic acid, 3-bromophenethyl ethyl ester. Succinic acid, 2-bromophenethyl isobutyl ester. Succinic acid, 3-bromophenethyl pentyl ester. Succinic acid, 4-bromophenethyl isobutyl ester. Succinic acid, 3-bromophenethyl hexyl ester. Succinic acid, 3-bromophenethyl nonyl ester. Succinic acid, 3-bromophenethyl tetradecyl ester. Succinic acid, 3-bromophenethyl dodecyl ester. Succinic acid, 3-bromophenethyl undecyl ester. Succinic acid, 3-bromophenethyl decyl ester. Succinic acid, 3-bromophenethyl heptyl ester.

Find more compounds similar to Succinic acid, 3-bromophenethyl isobutyl ester.

Sources

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