- InChI
- InChI=1S/C14H32N4/c1-15-7-5-8-17(3)13-14-18(4)10-6-9-16(2)12-11-15/h5-14H2,1-4H3
- InChI Key
- HRFJEOWVAGSJNW-UHFFFAOYSA-N
- Formula
- C14H32N4
- SMILES
- CN1CCCN(C)CCN(C)CCCN(C)CC1
- Molecular Weight1
- 256.43
- CAS
- 41203-22-9
- Other Names
-
- 1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane
- Tetramethylcyclam
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.4771 | Relay (... Calculated Property | |
| ΔfG° | 364.69 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -144.31 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 82.57 | kJ/mol | Relay (... Calculated Property |
| IE | 8.00 | eV | NIST |
| log10WS | 0.76 | Relay (... Calculated Property | |
| logPoct/wat | 0.507 | Crippen Calculated Property | |
| McVol | 237.180 | ml/mol | McGowan Calculated Property |
| Pc | 1817.50 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 587.40 | K | Relay (... Calculated Property |
| Tc | 776.41 | K | Relay (... Calculated Property |
| Tfus | 331.94 | K | Relay (... Calculated Property |
| Vc | 0.819 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 1,4,8,11-Tetraazacyclotetradecane, 1,4,8,11-tetramethyl-.
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
- McGowan Method
- NIST Webbook
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