Chemical Properties of 5-(4-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine, N,N'-bis(heptafluorobutyryl)-

5-(4-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine, N,N'-bis(heptafluorobutyryl)-

InChI
InChI=1S/C20H11ClF14N4O2/c1-2-9-10(7-3-5-8(21)6-4-7)11(37-12(40)15(22,23)17(26,27)19(30,31)32)38-14(36-9)39-13(41)16(24,25)18(28,29)20(33,34)35/h3-6H,2H2,1H3,(H2,36,37,38,39,40,41)
InChI Key
PDRDWYIUWFOWEG-UHFFFAOYSA-N
Formula
C20H11ClF14N4O2
SMILES
CCc1nc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)nc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)c1-c1ccc(Cl)cc1
Molecular Weight1
640.76
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Physical Properties

Property Value Unit Source
ω 0.9500 Relay (1.0) Calculated Property
ΔfG° -2475.25 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -3168.22 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 136.52 kJ/mol Relay (1.0) Calculated Property
IE 8.87 eV Relay (1.0) Calculated Property
log10WS -9.43 Relay (1.0) Calculated Property
logPoct/wat 6.902 Crippen Calculated Property
McVol 325.220 ml/mol McGowan Calculated Property
Pc 932.39 kPa Relay (1.0-beta) Calculated Property
Inp [2135.00; 2135.00]   Show Hide
Inp 2135.00 NIST
Inp 2135.00 NIST
Tboil 656.86 K Relay (1.0) Calculated Property
Tc 909.49 K Relay (1.0) Calculated Property
Tfus 434.90 K Relay (1.0) Calculated Property
Vc 1.203 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

5-(4-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine, N,N'-bis(pentafluoropropionyl)-. 5-(4-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine, N,N'-bis(trifluoroacetyl)-. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-, (5'«alpha»)-. AJMALINE, M(DIHYDRO-), AC. Dihydroergokryptine. 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.

Find more compounds similar to 5-(4-Chlorophenyl)-6-ethylpyrimidine-2,4-diamine, N,N'-bis(heptafluorobutyryl)-.

Sources

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