Chemical Properties of N-tert-Butyl-N,N'-bis(trifluoroacetyl)-6-methoxy-1,3,5-triazine-2,4-diamine

N-tert-Butyl-N,N'-bis(trifluoroacetyl)-6-methoxy-1,3,5-triazine-2,4-diamine

InChI
InChI=1S/C12H13F6N5O3/c1-10(2,3)23(6(25)12(16,17)18)8-20-7(21-9(22-8)26-4)19-5(24)11(13,14)15/h1-4H3,(H,19,20,21,22,24)
InChI Key
CODZVNZYBUJIRS-UHFFFAOYSA-N
Formula
C12H13F6N5O3
SMILES
COc1nc(NC(=O)C(F)(F)F)nc(N(C(=O)C(F)(F)F)C(C)(C)C)n1
Molecular Weight1
389.25
Other Names
  • 2-Trifluoroacetylamino-4-tert-butyl-4-trifluoroacetylamino-6-methoxy-1,3,5-triazine
  • 6-Methoxy-N-(2-methyl-2-propanyl)-N,N'-bis(trifluoroacetyl)-1,3,5-triazine-2,4-diamine
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Physical Properties

Property Value Unit Source
ω 0.7204 Relay (1.0) Calculated Property
ΔfG° -909.97 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -1675.36 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 94.53 kJ/mol Relay (1.0) Calculated Property
IE 9.22 eV Relay (1.0) Calculated Property
log10WS -4.82 Relay (1.0) Calculated Property
logPoct/wat 2.075 Crippen Calculated Property
McVol 225.710 ml/mol McGowan Calculated Property
Pc 1474.30 kPa Relay (1.0-beta) Calculated Property
Inp 1571.00 NIST
Tboil 516.07 K Relay (1.0) Calculated Property
Tc 802.64 K Relay (1.0) Calculated Property
Tfus 412.16 K Relay (1.0) Calculated Property
Vc 0.855 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

N2-Cyclopropyl-1,3,5-triazine-2,4,6-triamine N2,N4,N6-tris(trifluoroacetate). N-tert-Butyl-N-trifluoroacetyl-N'-trifluoroacetyl-N'-cyclopropyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine. N-tert-Butyl-N'-acetyl-6-methoxy-1,3,5-triazine-2,4-diamine. N-Isopropyl-N'-methyl-N,N'-bis(trifluoroacetyl)-6-methylsulfanyl-1,3,5-triazine-2,4-diamine. 4-(tert-Butylamino)-6-ethyl-6-trifluoroacetylamino-5H-1,3,5-triazin-2-one. N-tert-Butyl-N'-acetyl-N'-cyclopropyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine. N-(1,2-Dimethylpropyl)-N,N-bis(heptafluorobutyryl)-N'-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine. N-(1,2-Dimethylpropyl)-N,N'-bis(trifluoroacetyl)-N'-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine. N-(1,2-Dimethylpropyl)-N,N'-bis(pentafluoropropionyl)-N'-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine. Adenosine, 2'-deoxy-N-(trifluoroacetyl)-, 3',5'-bis(trifluoroacetate). «beta»-tiglyl-trachelanthamine, TMS. «beta»-angelyl-trachelanthamine, TMS. Benzenepropanol, 3-hydroxy-4-(2-hydroxy-1-hydroxymethyl-2-(4-hydroxy-3-methoxyphenyl))ethyl, pentakis-TMS. Indol-4(5H)-one, 3-ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)-. 4-amino-1-[4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one.

Find more compounds similar to N-tert-Butyl-N,N'-bis(trifluoroacetyl)-6-methoxy-1,3,5-triazine-2,4-diamine.

Sources

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