Chemical Properties of 15(S)-15-Methyl-PGB2, BO-TMS

InChI

InChI=1S/C31H57NO4Si2/c1-10-12-18-24-31(3,36-38(7,8)9)25-23-27-21-22-29(32-34-26-13-11-2)28(27)19-16-14-15-17-20-30(33)35-37(4,5)6/h14,16,23,25H,10-13,15,17-22,24,26H2,1-9H3/b16-14-,25-23+,32-29+/t31-/m1/s1

InChI Key

BOMRYIBKVKYZFO-QQTMMTGTSA-N

Formula

C31H57NO4Si2

SMILES

CCCCCC(C)(C=CC1=C(CC=CCCCC(=O)O[Si](C)(C)C)C(=NOCCCC)CC1)O[Si](C)(C)C

Molecular Weight¹

563.96

• logP_oct/wat : Octanol/Water partition coefficient.
• 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, 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.

Similar Compounds

Find more compounds similar to 15(S)-15-Methyl-PGB2, BO-TMS.

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
• NIST Webbook

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