- InChI
- InChI=1S/C5H6N2O2/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)
- InChI Key
- SHVCSCWHWMSGTE-UHFFFAOYSA-N
- Formula
- C5H6N2O2
- SMILES
- Cc1cc(=O)[nH]c(=O)[nH]1
- Molecular Weight1
- 126.11
- CAS
- 626-48-2
- Other Names
-
- 2(1H)-Pyrimidinone, 4-hydroxy-6-methyl-
- 2,4(1H,3H)-Pyrimidinedione, 6-methyl-
- 2,4-Dihydroxy-6-methylpyrimidine
- 2,4-Pyrimidinediol, 6-methyl-
- 4-(6)-Methyluracil
- 4-Methyluracil
- 6-Methyl-1H-pyrimidine-2,4-dione
- AWD 23-15
- NSC 9456
- Pseudothymine
- Uracil, 6-methyl-
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,solid : Solid phase heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔsubH° : Enthalpy of sublimation 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 | 0.5310 | Relay (... Calculated Property | |
| ΔcH°solid | [-2374.00; -2356.90] | kJ/mol |
|
| ΔcH°solid | -2356.90 ± 0.25 | kJ/mol | NIST |
| ΔcH°solid | -2374.00 | kJ/mol | NIST |
| ΔcH°solid | -2372.70 | kJ/mol | NIST |
| ΔfG° | -82.42 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -297.82 | kJ/mol | Relay (... Calculated Property |
| ΔsubH° | 131.00 | kJ/mol | NIST |
| ΔvapH° | 99.56 | kJ/mol | Relay (... Calculated Property |
| IE | 8.73 | eV | Relay (... Calculated Property |
| log10WS | -1.26 | Aq. Sol... | |
| logPoct/wat | -1.592 | Crippen Calculated Property | |
| McVol | 89.250 | ml/mol | McGowan Calculated Property |
| Pc | 5588.02 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 569.41 | K | Relay (... Calculated Property |
| Tc | 786.85 | K | Relay (... Calculated Property |
| Tfus | 491.33 | K | Relay (... Calculated Property |
| Vc | 0.315 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,solid | [162.50; 193.00] | J/mol×K | [298.15; 343.15] |
|
| Cp,solid | 162.50 | J/mol×K | 298.15 | Heat Ca... |
| Cp,solid | 167.20 | J/mol×K | 303.15 | Heat Ca... |
| Cp,solid | 170.20 | J/mol×K | 308.15 | Heat Ca... |
| Cp,solid | 172.20 | J/mol×K | 313.15 | Heat Ca... |
| Cp,solid | 176.90 | J/mol×K | 318.15 | Heat Ca... |
| Cp,solid | 181.40 | J/mol×K | 323.15 | Heat Ca... |
| Cp,solid | 183.00 | J/mol×K | 328.15 | Heat Ca... |
| Cp,solid | 187.30 | J/mol×K | 333.15 | Heat Ca... |
| Cp,solid | 190.40 | J/mol×K | 338.15 | Heat Ca... |
| Cp,solid | 193.00 | J/mol×K | 343.15 | Heat Ca... |
Similar Compounds
Find more compounds similar to 6-Methyluracil.
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
- Thermochemical study of 5-methyluracil, 6-methyluracil, and 5-nitrouracil
- Heat Capacities of Uracil, Thymine, and Its Alkylated, Cyclooligomethylenated, and Halogenated Derivatives by Differential Calorimetry
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.