- InChI
- InChI=1S/C3H4N4O2/c4-1-5-2(8)7-3(9)6-1/h(H4,4,5,6,7,8,9)
- InChI Key
- YSKUZVBSHIWEFK-UHFFFAOYSA-N
- Formula
- C3H4N4O2
- SMILES
- Nc1nc(=O)[nH]c(=O)[nH]1
- Molecular Weight1
- 128.09
- CAS
- 645-93-2
- Other Names
-
- Ammelide
- 1,3,5-Triazine-2,4(1H,3H)-dione, 6-amino-
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°solid | -1259.00 ± 4.20 | kJ/mol | NIST |
| ΔfH°solid | -492.90 ± 4.20 | kJ/mol | NIST |
| log10WS | 1.85 | Crippen Calculated Property | |
| logPoct/wat | -2.923 | Crippen Calculated Property | |
| McVol | 81.030 | ml/mol | McGowan Calculated Property |
Similar Compounds
Find more compounds similar to 6-Amino-1,3,5-triazine-2,4(1H,3H)-dione.
Sources
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