![[2H3]Dihydrozeatin, permethylated](/cid/49-632-6/2H3-Dihydrozeatin-permethylated.png "[2H3]Dihydrozeatin, permethylated")
- InChI
- InChI=1S/C13H21N5O/c1-10(7-19-4)5-6-17(2)12-11-13(15-8-14-12)18(3)9-16-11/h8-10H,5-7H2,1-4H3
- InChI Key
- UGMSICOXWWKJRQ-UHFFFAOYSA-N
- Formula
- C13H21N5O
- SMILES
- COCC(C)CCN(C)c1ncnc2c1ncn2C
- Molecular Weight1
- 263.34
- Other Names
-
- Dihydrozeatin, permethylated
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.7328 | Relay (1.0) Calculated Property | |
| ΔfG° | 374.77 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 37.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 92.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.78 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.472 | Crippen Calculated Property | |
| McVol | 210.880 | ml/mol | McGowan Calculated Property |
| Pc | 2328.64 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2223.00; 2225.00] |
|
|
| Inp | 2224.00 | NIST | |
| Inp | 2225.00 | NIST | |
| Inp | 2223.00 | NIST | |
| Tboil | 634.66 | K | Relay (1.0) Calculated Property |
| Tc | 894.17 | K | Relay (1.0) Calculated Property |
| Tfus | 325.42 | K | Relay (1.0) Calculated Property |
| Vc | 0.786 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to [2H3]Dihydrozeatin, permethylated.
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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