- InChI
- InChI=1S/C9H21N3/c1-8(2)7-10-9(11(3)4)12(5)6/h8H,7H2,1-6H3
- InChI Key
- CKJXIIJERUAQNR-UHFFFAOYSA-N
- Formula
- C9H21N3
- SMILES
- CC(C)CN=C(N(C)C)N(C)C
- Molecular Weight1
- 171.28
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization 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).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -26.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.72 | kJ/mol | Joback Calculated Property |
| log10WS | -0.64 | Crippen Calculated Property | |
| logPoct/wat | 1.122 | Crippen Calculated Property | |
| McVol | 163.310 | ml/mol | McGowan Calculated Property |
| Pc | 2108.07 | kPa | Joback Calculated Property |
| Inp | [1163.00; 1163.00] |
|
|
| Inp | 1163.00 | NIST | |
| Inp | 1163.00 | NIST | |
| Tboil | 506.32 | K | Joback Calculated Property |
| Tc | 691.91 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N''-Isobutyl-N,N,N',N'-tetramethyl -guanidine.
Sources
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