Chemical Properties of Barbituric acid, 5-hydroxy-5-thiosemicarbazido-

Barbituric acid, 5-hydroxy-5-thiosemicarbazido-

InChI
InChI=1S/C5H7N5O4S/c6-3(15)9-10-5(14)1(11)7-4(13)8-2(5)12/h10,14H,(H3,6,9,15)(H2,7,8,11,12,13)
InChI Key
GOHDTOFXBVDEDM-UHFFFAOYSA-N
Formula
C5H7N5O4S
SMILES
NC(=S)NNC1(O)C(=O)NC(=O)NC1=O
Molecular Weight1
233.21
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Physical Properties

Property Value Unit Source
ΔfusH° 36.04 kJ/mol Joback Calculated Property
logPoct/wat -3.621 Crippen Calculated Property
McVol 142.980 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [445.63; 504.67] J/mol×K [969.44; 1239.42] Show Hide
Cp,gas 445.63 J/mol×K 969.44 Joback Calculated Property
Cp,gas 456.18 J/mol×K 1014.44 Joback Calculated Property
Cp,gas 466.38 J/mol×K 1059.43 Joback Calculated Property
Cp,gas 476.27 J/mol×K 1104.43 Joback Calculated Property
Cp,gas 485.91 J/mol×K 1149.43 Joback Calculated Property
Cp,gas 495.36 J/mol×K 1194.42 Joback Calculated Property
Cp,gas 504.67 J/mol×K 1239.42 Joback Calculated Property

Similar Compounds

MIRTAZAPINE. Mirtazapine-M (HO-) AC. Mirtazapine-M (nor-HO-) 2AC. Mirtazapine-M (nor-HO-methoxy-) 2AC. Mirtazapine-M (nor-) AC. Biotin, N,N'-(trimethylsilyl)-, trimethylsilyl ester. N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether, benzyloxime (isomer 1). N-Acetyl-D-glucosamine, tetrakis(trimethylsilyl) ether, benzyloxime (isomer 2). Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. cefuroxime acid. (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. 1,2,3,4-Tetrahydroanthracene-cis-1,2-diol, ferrocenylboronate. Butorphanol di-TMS derivative. Hydrastine. N-Desmethylmirtazapine.

Find more compounds similar to Barbituric acid, 5-hydroxy-5-thiosemicarbazido-.

Sources

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