- InChI
- InChI=1S/C39H30N6/c1-7-19-31(20-8-1)43(32-21-9-2-10-22-32)37-40-38(44(33-23-11-3-12-24-33)34-25-13-4-14-26-34)42-39(41-37)45(35-27-15-5-16-28-35)36-29-17-6-18-30-36/h1-30H
- InChI Key
- YGXMMMPUTDCEAF-UHFFFAOYSA-N
- Formula
- C39H30N6
- SMILES
-
c1ccc(N(c2ccccc2)c2nc(N(c3cccc
c3)c3ccccc3)nc(N(c3ccccc3)c3cc ccc3)n2)cc1 - Molecular Weight1
- 582.70
- CAS
- 18343-40-3
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,solid : Solid phase heat capacity (J/mol×K).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- S°solid,1 bar : Solid phase molar entropy at standard conditions (J/mol×K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°solid | -20095.00 ± 10.00 | kJ/mol | NIST |
| ΔfH°solid | 460.00 ± 10.00 | kJ/mol | NIST |
| log10WS | -11.27 | Crippen Calculated Property | |
| logPoct/wat | 10.281 | Crippen Calculated Property | |
| McVol | 453.930 | ml/mol | McGowan Calculated Property |
| S°solid,1 bar | 673.70 | J/mol×K | NIST |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,solid | 665.80 | J/mol×K | 298.15 | NIST |
Similar Compounds
Find more compounds similar to Hexaphenylmelamine.
Sources
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