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Cas Database |
| Name |
4,5,6-Triaminopyrimidine |
EINECS | N/A |
| CAS No. | 118-70-7 | Density | 1.512g/cm3 |
| PSA | 103.84000 | LogP | 0.96680 |
| Solubility | N/A | Melting Point |
257 °C (decomp)(Solv: water (7732-18-5)) |
| Formula | C4H7 N5 | Boiling Point | 406.2°Cat760mmHg |
| Molecular Weight | 125.133 | Flash Point | 228.5°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Pyrimidine,4,5,6-triamino- (6CI,7CI,8CI); 4,5,6-Triaminopyrimidine; NSC 145059 |
Article Data | 26 |
4,5,6-Triaminopyrimidine Chemical Properties
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IUPAC Name: Pyrimidine-4,5,6-triamine
Empirical Formula: C4H7N5
Molecular Weight: 125.1319
Canonical SMILES: C1=NC(=C(C(=N1)N)N)N
InChI: InChI=1S/C4H7N5/c5-2-3(6)8-1-9-4(2)7/h1H,5H2,(H4,6,7,8,9)
InChIKey: MPNBXFXEMHPGTK-UHFFFAOYSA-N
XLogP3-AA: -1.2
H-Bond Donor: 3
H-Bond Acceptor: 5
Index of Refraction: 1.793
Molar Refractivity: 35.14 cm3
Molar Volume: 82.7 cm3
Surface Tension: 118.7 dyne/cm
Density: 1.512 g/cm3
Flash Point: 228.5 °C
Enthalpy of Vaporization: 65.79 kJ/mol
Boiling Point: 406.2 °C at 760 mmHg
Vapour Pressure of 4,5,6-Pyrimidinetriamine (CAS NO.118-70-7): 8.28E-07 mmHg at 25 °C
4,5,6-Triaminopyrimidine Specification
4,5,6-Pyrimidinetriamine (CAS NO.118-70-7), its Synonyms are 4,5,6-Pyrimidinetriamine (9CI) ; Pyrimidine, 4,5,6-triamino- (8CI) ; Pyrimidine-4,5,6-triyltriamine .
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