- InChI
- InChI=1S/C3H5N5O/c4-1-6-2(5)8-3(9)7-1/h(H5,4,5,6,7,8,9)
- InChI Key
- MASBWURJQFFLOO-UHFFFAOYSA-N
- Formula
- C3H5N5O
- SMILES
- Nc1nc(N)[nH]c(=O)n1
- Molecular Weight1
- 127.10
- CAS
- 645-92-1
- Other Names
-
- s-Triazin-2-ol, 4,6-diamino-
- Ammelin
- Ammeline
- 2,4-Diamino-1,3,5-triazin-6-one
- 4,6-Diamino-1,3,5-triazin-2(1H)-one
- 4,6-Diamino-1,3,5-triazin-2-ol
- Ammeline, (4,6-diamino-5-triazin-2-ol)
- 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 | -1595.00 ± 2.00 | kJ/mol | NIST |
| ΔfH°solid | -300.00 ± 2.00 | kJ/mol | NIST |
| log10WS | 1.09 | Crippen Calculated Property | |
| logPoct/wat | -2.153 | Crippen Calculated Property | |
| McVol | 85.140 | ml/mol | McGowan Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-Triazin-2(1H)-one, 4,6-diamino-.
Sources
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