Chemical Properties of Urea], 1,1'-trimethylenebis[3-methyl-3-nitroso- (CAS 13404-51-8)

InChI

InChI=1S/C7H14N6O4/c1-12(10-16)6(14)8-4-3-5-9-7(15)13(2)11-17/h3-5H2,1-2H3,(H,8,14)(H,9,15)

InChI Key

VNYXNTQYEYQRCJ-UHFFFAOYSA-N

Formula

C7H14N6O4

SMILES

CN(N=O)C(=O)NCCCNC(=O)N(C)N=O

Molecular Weight¹

246.22

CAS

13404-51-8

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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 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.

Similar Compounds

Find more compounds similar to Urea], 1,1'-trimethylenebis[3-methyl-3-nitroso-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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