Chemical Properties of Glutaric acid, 3-methylbut-2-en-1-yl 2-bromo-4-fluorophenyl ester

Glutaric acid, 3-methylbut-2-en-1-yl 2-bromo-4-fluorophenyl ester

InChI
InChI=1S/C16H18BrFO4/c1-11(2)8-9-21-15(19)4-3-5-16(20)22-14-7-6-12(18)10-13(14)17/h6-8,10H,3-5,9H2,1-2H3
InChI Key
YMQXMHYWPYOANT-UHFFFAOYSA-N
Formula
C16H18BrFO4
SMILES
CC(C)=CCOC(=O)CCCC(=O)Oc1ccc(F)cc1Br
Molecular Weight1
373.21
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Physical Properties

Property Value Unit Source
Δfus 46.45 kJ/mol Joback Calculated Property
logPoct/wat 4.173 Crippen Calculated Property
McVol 242.390 ml/mol McGowan Calculated Property
Inp [2270.00; 2270.00]   Show Hide
Inp 2270.00 NIST
Inp 2270.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [659.01; 721.40] J/mol×K [788.23; 998.71] Show Hide
Cp,gas 659.01 J/mol×K 788.23 Joback Calculated Property
Cp,gas 671.81 J/mol×K 823.31 Joback Calculated Property
Cp,gas 683.61 J/mol×K 858.39 Joback Calculated Property
Cp,gas 694.43 J/mol×K 893.47 Joback Calculated Property
Cp,gas 704.31 J/mol×K 928.55 Joback Calculated Property
Cp,gas 713.29 J/mol×K 963.63 Joback Calculated Property
Cp,gas 721.40 J/mol×K 998.71 Joback Calculated Property

Similar Compounds

Succinic acid, 3-methylbut-2-en-1-yl 2-bromo-4-fluorophenyl ester. Glutaric acid, dodec-2-en-1-yl 2-bromo-4-fluorophenyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 4-bromophenyl ester. Glutaric acid, 2,2-dichloroethyl 2-bromo-4-fluorophenyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 3-fluorophenyl ester. Succinic acid, dodec-2-en-1-yl 2-bromo-4-fluorophenyl ester. Sebacic acid, 2-bromo-4-fluorophenyl ethyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 4-bromo-2-methoxyphenyl ester. Sebacic acid, 2-bromo-4-fluorophenyl propyl ester. Glutaric acid, but-3-yn-2-yl 2-bromo-4-fluorophenyl ester. Glutaric acid, tridec-2-yn-1-yl 2-bromo-4-fluorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-bromo-4-fluorophenyl ester. Sebacic acid, 2-bromo-4-fluorophenyl butyl ester. Sebacic acid, 2-bromo-4-fluorophenyl pentyl ester. Sebacic acid, 2-bromo-4-fluorophenyl isobutyl ester.

Find more compounds similar to Glutaric acid, 3-methylbut-2-en-1-yl 2-bromo-4-fluorophenyl ester.

Sources

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