Chemical Properties of Barbituric acid, 5-methyl-5-phenyl perbutylated

Barbituric acid, 5-methyl-5-phenyl perbutylated

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InChI
InChI=1S/C19H26N2O3/c1-4-6-13-20-16(22)19(3,15-11-9-8-10-12-15)17(23)21(18(20)24)14-7-5-2/h8-12H,4-7,13-14H2,1-3H3
InChI Key
BDEGLSYKHQSELU-UHFFFAOYSA-N
Formula
C19H26N2O3
SMILES
CCCCN1C(=O)N(CCCC)C(=O)C(C)(c2ccccc2)C1=O
Molecular Weight1
330.42
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Physical Properties

Property Value Unit Source
ω 0.7723 Relay (... Calculated Property
ΔfG° -29.85 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -537.37 kJ/mol Relay (... Calculated Property
ΔvapH° 89.71 kJ/mol Relay (... Calculated Property
IE 8.77 eV Relay (... Calculated Property
log10WS -4.26 Relay (... Calculated Property
logPoct/wat 3.335 Crippen Calculated Property
McVol 268.620 ml/mol McGowan Calculated Property
Pc 1349.39 kPa Relay (... Calculated Property ⚠️
Inp 2187.00 NIST
Tboil 637.14 K Relay (... Calculated Property
Tc 909.78 K Relay (... Calculated Property
Tfus 350.76 K Relay (... Calculated Property
Vc 0.980 m3/kmol Relay (... Calculated Property

Similar Compounds

Barbituric acid, 5-methyl-5-phenyl perethylated. Mephobarbital perbutylated. 1,3-Di-n-butyl phenobarbital. 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,5-diethyl-3-methyl-5-phenyl-. 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3,5-triethyl-5-phenyl-. 1-N-butyl-phenobarbital. 2-Pyrrolidinone, 1-ethyl-4-[2-(4-morpholinyl)ethyl]-3,3-diphenyl-. L-Alanine, N-[N-[N-[N-(1-oxodecyl)glycyl]-L-tryptophyl]-L-alanyl]-, methyl ester. Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Maprotiline M(HO-ethanediyl), diacetylated. 13-Tigloyloxylupanine. Quinapril Me. Dimetindene M (nor, OH), acetylated. Valine-glutamine-tryptophan-leucine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. (-)-Bunolol methoxime, PFB-TMS.

Find more compounds similar to Barbituric acid, 5-methyl-5-phenyl perbutylated.

Sources

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