Chemical Properties of DOPA, HFIP-PFP

DOPA, HFIP-PFP

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InChI
InChI=1S/C21H8F21NO7/c22-14(23,19(34,35)36)11(45)43-6(9(44)50-10(17(28,29)30)18(31,32)33)3-5-1-2-7(48-12(46)15(24,25)20(37,38)39)8(4-5)49-13(47)16(26,27)21(40,41)42/h1-2,4,6,10H,3H2,(H,43,45)
InChI Key
IBBQYKLYEGERBB-UHFFFAOYSA-N
Formula
C21H8F21NO7
SMILES
O=C(OC(C(F)(F)F)C(F)(F)F)C(Cc1ccc(OC(=O)C(F)(F)C(F)(F)F)c(OC(=O)C(F)(F)C(F)(F)F)c1)NC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
785.26
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Physical Properties

Property Value Unit Source
Δf -4595.37 kJ/mol Joback Calculated Property
Δfgas -5255.56 kJ/mol Joback Calculated Property
Δfus 56.79 kJ/mol Joback Calculated Property
Δvap 78.29 kJ/mol Joback Calculated Property
log10WS -8.97 Crippen Calculated Property
logPoct/wat 6.154 Crippen Calculated Property
McVol 354.030 ml/mol McGowan Calculated Property
Pc 818.20 kPa Joback Calculated Property
Inp [1386.00; 1386.00]   Show Hide
Inp 1386.00 NIST
Inp 1386.00 NIST
Tboil 1007.38 K Joback Calculated Property
Tc 1270.84 K Joback Calculated Property
Tfus 698.71 K Joback Calculated Property
Vc 1.494 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1189.56; 1246.36] J/mol×K [1007.38; 1270.84] Show Hide
Cp,gas 1189.56 J/mol×K 1007.38 Joback Calculated Property
Cp,gas 1199.00 J/mol×K 1051.29 Joback Calculated Property
Cp,gas 1207.97 J/mol×K 1095.20 Joback Calculated Property
Cp,gas 1216.82 J/mol×K 1139.11 Joback Calculated Property
Cp,gas 1225.93 J/mol×K 1183.02 Joback Calculated Property
Cp,gas 1235.65 J/mol×K 1226.93 Joback Calculated Property
Cp,gas 1246.36 J/mol×K 1270.84 Joback Calculated Property

Similar Compounds

Dihydroxyphenylalanine, TFE-PFP. Tyr, HFIP-PFP. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 1. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. Thebacon. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

Find more compounds similar to DOPA, HFIP-PFP.

Sources

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