Chemical Properties of 2-Hydroxy-5-nitrobenzyl alcohol, bis(pentafluoropropionate)

2-Hydroxy-5-nitrobenzyl alcohol, bis(pentafluoropropionate)

InChI
InChI=1S/C13H5F10NO6/c14-10(15,12(18,19)20)8(25)29-4-5-3-6(24(27)28)1-2-7(5)30-9(26)11(16,17)13(21,22)23/h1-3H,4H2
InChI Key
GICYDGRWESWUQK-UHFFFAOYSA-N
Formula
C13H5F10NO6
SMILES
O=C(OCc1cc([N+](=O)[O-])ccc1OC(=O)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F
Molecular Weight1
461.16
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Physical Properties

Property Value Unit Source
Δfus 43.93 kJ/mol Joback Calculated Property
logPoct/wat 3.939 Crippen Calculated Property
McVol 220.270 ml/mol McGowan Calculated Property
Inp [1461.00; 1461.00]   Show Hide
Inp 1461.00 NIST
Inp 1461.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [665.18; 701.26] J/mol×K [781.74; 973.78] Show Hide
Cp,gas 665.18 J/mol×K 781.74 Joback Calculated Property
Cp,gas 673.11 J/mol×K 813.75 Joback Calculated Property
Cp,gas 680.17 J/mol×K 845.75 Joback Calculated Property
Cp,gas 686.45 J/mol×K 877.76 Joback Calculated Property
Cp,gas 692.01 J/mol×K 909.77 Joback Calculated Property
Cp,gas 696.92 J/mol×K 941.77 Joback Calculated Property
Cp,gas 701.26 J/mol×K 973.78 Joback Calculated Property

Similar Compounds

2-Hydroxy-5-nitrobenzyl alcohol, bis(heptafluorobutyrate). 2-Hydroxy-5-nitrobenzyl alcohol, bis(trifluoroacetate). 2-Hydroxybenzyl alcohol, bis(pentafluoropropionate). 5-Bromo-2-hydroxybenzyl alcohol, bis(pentafluoropropionate). 2-Hydroxybenzyl alcohol, bis(heptafluorobutyrate). 5-Bromo-2-hydroxybenzyl alcohol, bis(heptafluorobutyrate). Carteolol hydroxy, acetylated. (-)-2-Aminobutan-1-ol, ferroceneboronate derivative. Carteolol, acetylated. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. 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. Cytosine arabinoside, dimethyl-allyldimethylsilyl derivative. N6-(cyclotetramethylene-tertbutylsilyl)-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. 2'-Deoxyadenosine, 3',5',N6-tris(O-TMTBSi).

Find more compounds similar to 2-Hydroxy-5-nitrobenzyl alcohol, bis(pentafluoropropionate).

Sources

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