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Cas Database |
| Name |
2,4-Diamino-5-cyanopyrimidine |
EINECS | N/A |
| CAS No. | 16462-27-4 | Density | 1.45g/cm3 |
| PSA | 101.61000 | LogP | 0.67508 |
| Solubility | N/A | Melting Point |
318 °C (decomp) |
| Formula | C5H5 N5 | Boiling Point | 498.2°Cat760mmHg |
| Molecular Weight | 135.128 | Flash Point | 255.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2,4-Diamino-5-cyanopyrimidine;2,4-Diaminopyrimidine-5-carbonitrile; NSC 135235 |
Article Data | 2 |
2,4-Diamino-5-cyanopyrimidine Chemical Properties
IUPAC Name: 2,4-Diaminopyrimidine-5-carbonitrile
Synonyms of 2,4-Diamino-5-cyanopyrimidine (CAS NO.16462-27-4): 5-Pyrimidinecarbonitrile,2,4-diamino- ; 2,4-diaminopyrimidine-5-carbonitrile ; 2,4-Diamino-5-pyrimidinecarbonitrile
CAS NO: 16462-27-4
Molecular Formula: C5H5N5
Molecular Weight: 135.13
Molecular Structure: 
H bond acceptors: 5
H bond donors: 4
Freely Rotating Bonds: 0
Polar Surface Area: 56.05 Å2
Index of Refraction: 1.658
Molar Refractivity: 34.15 cm3
Molar Volume: 92.7 cm3
Surface Tension: 109.6 dyne/cm
Density: 1.45 g/cm3
Flash Point: 255.1 °C
Enthalpy of Vaporization: 76.63 kJ/mol
Boiling Point: 498.2 °C at 760 mmHg
Vapour Pressure: 4.62E-10 mmHg at 25°C
SMILES: N#Cc1cnc(nc1N)N
InChI: InChI=1/C5H5N5/c6-1-3-2-9-5(8)10-4(3)7/h2H,(H4,7,8,9,10)
InChIKey: OYUQCQCQLDTRHQ-UHFFFAOYAW
Std. InChI: InChI=1S/C5H5N5/c6-1-3-2-9-5(8)10-4(3)7/h2H,(H4,7,8,9,10)
Std. InChIKey: OYUQCQCQLDTRHQ-UHFFFAOYSA-N
Product Categories of 2,4-Diamino-5-cyanopyrimidine (CAS NO.16462-27-4): PYRIMIDINE
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