Chemical Properties of N,N'-Trimethyleneurea (CAS 1852-17-1)

N,N'-Trimethyleneurea

InChI
InChI=1S/C4H8N2O/c7-4-5-2-1-3-6-4/h1-3H2,(H2,5,6,7)
InChI Key
NQPJDJVGBDHCAD-UHFFFAOYSA-N
Formula
C4H8N2O
SMILES
OC1=NCCCN1
Molecular Weight1
100.12
CAS
1852-17-1
Other Names
  • 2(1H)-Pyrimidinone, tetrahydro-
  • 2(1H)-Tetrahydropyrimidinone
  • 2-Ketohexahydropyrimidine
  • 2-Pyrimidinol, 3,4,5,6-tetrahydro-
  • Hexahydro-2(1H)-pyrimidinone
  • Hexahydropyrimidin-2-one
  • NSC 21315
  • Propyleneurea
  • Pyrimidine, hexahydro-2-oxo-
  • Tetrahydro-2-pyrimidone
  • Urea, 1,3-trimethylene-
  • Urea, N,N'-(1,3-propanediyl)-
  • perhydropyrimidin-2-one
  • tetrahydropyrimidin-2(1H)-one
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Physical Properties

Property Value Unit Source
ΔfusH° 16.53 kJ/mol Joback Calculated Property
ΔsubH° [89.30; 113.40] kJ/mol Show Hide
ΔsubH° 113.40 ± 0.70 kJ/mol NIST
ΔsubH° 89.30 kJ/mol NIST
logPoct/wat -0.106 Crippen Calculated Property
McVol 77.890 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 [178.51; 234.56] J/mol×K [513.91; 734.75] Show Hide
Cp,gas 178.51 J/mol×K 513.91 Joback Calculated Property
Cp,gas 189.21 J/mol×K 550.72 Joback Calculated Property
Cp,gas 199.37 J/mol×K 587.52 Joback Calculated Property
Cp,gas 209.00 J/mol×K 624.33 Joback Calculated Property
Cp,gas 218.08 J/mol×K 661.14 Joback Calculated Property
Cp,gas 226.60 J/mol×K 697.95 Joback Calculated Property
Cp,gas 234.56 J/mol×K 734.75 Joback Calculated Property
Cp,solid [117.20; 224.90] J/mol×K [268.15; 470.15] Show Hide
Cp,solid 117.20 J/mol×K 268.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 118.00 J/mol×K 270.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 120.10 J/mol×K 275.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 122.20 J/mol×K 280.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 124.10 J/mol×K 285.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 126.20 J/mol×K 290.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 128.10 J/mol×K 295.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 129.50 J/mol×K 298.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 130.40 J/mol×K 300.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 132.70 J/mol×K 305.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 135.30 J/mol×K 310.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 137.80 J/mol×K 315.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 140.20 J/mol×K 320.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 142.60 J/mol×K 325.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 145.10 J/mol×K 330.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 147.30 J/mol×K 335.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 150.10 J/mol×K 340.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 152.20 J/mol×K 345.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 155.10 J/mol×K 350.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 157.20 J/mol×K 355.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 159.90 J/mol×K 360.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 163.80 J/mol×K 365.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 166.50 J/mol×K 370.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 169.80 J/mol×K 375.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 172.40 J/mol×K 380.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 175.10 J/mol×K 385.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 177.30 J/mol×K 390.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 180.40 J/mol×K 395.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 183.30 J/mol×K 400.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 186.50 J/mol×K 405.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 189.80 J/mol×K 410.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 193.90 J/mol×K 415.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 197.10 J/mol×K 420.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 200.80 J/mol×K 425.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 202.70 J/mol×K 430.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 204.90 J/mol×K 435.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 207.50 J/mol×K 440.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 210.30 J/mol×K 445.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 213.30 J/mol×K 450.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 215.90 J/mol×K 455.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 219.10 J/mol×K 460.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 222.20 J/mol×K 465.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea
Cp,solid 224.90 J/mol×K 470.15 Structural studies of cyclic ureas: 1. Enthalpies of formation of imidazolidin-2-one and N,N0-trimethyleneurea

Similar Compounds

2H-PYRIMIDO[1,2-A]PYRIMIDINE, 1,3,4,6,7,8-HEXAHYDRO-. Urea, 1-(2-cyanoethyl)-3-methyl-. OXYPHENCYCLIMINE. Anabasine. C10H14N2. Cyclohexanecarboxylic acid, 1-[3-(2-chloroethyl)ureido]-3-methyl-, ethyl ester. Triamcinolone Acetonide. 4-(ethylamino)-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2-methoxy-phenol, TES. Scopoletin «beta»-D-glucopyranoside, TFA. 1-Methyl-3-piperidyl cyclopentylphenylglycolate. Vanillin, «beta»-D-glucopyranoside, TFA. 4-Piperidyl cyclopentylphenylglycolate. Antheridic acid, MeTMS. 2-Hydroxymethyl-3-(o-tolyl)-4(3H)-quinazolinone (Methaqualone M).

Find more compounds similar to N,N'-Trimethyleneurea.

Sources

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