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| Name |
5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrazine |
EINECS | N/A |
| CAS No. | 837430-14-5 | Density | 1.539g/cm3 |
| PSA | 42.74000 | LogP | -0.28990 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C5 H8 N4 . Cl H | Boiling Point | 319.763 °C at 760 mmHg |
| Molecular Weight | 160.606 | Flash Point | 147.187 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1,2,4-Triazolo[4,3-a]pyrazine,5,6,7,8-tetrahydro-, monohydrochloride (9CI);5,6,7,8-Tetrahydro-1,2,4-triazolo[4,3-a]pyrazinehydrochloride;5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrazinemonohydrochloride; |
5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrazine Specification
The 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrazine with cas registry number of 837430-14-5, is also named 1,2,4-Triazolo[4,3-a]pyrazine,5,6,7,8-tetrahydro-, monohydrochloride (9CI) ; 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrazinemonohydrochloride .
Physical properties of 5,6,7,8-Tetrahydro[1,2,4]triazolo[4,3-a]pyrazine :(1)ACD/LogP: -2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 2; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 42.74 Å2; (11)Index of Refraction: 1.773; (12)Molar Refractivity: 33.604 cm3; (13)Molar Volume: 80.663 cm3; (14)Polarizability: 13.322×10-24cm3; (15)Surface Tension: 67.497 dyne/cm; (16)Enthalpy of Vaporization: 56.138 kJ/mol; (17)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure: (1)SMILES:c1nnc2n1CCNC2; (2)InChI:InChI=1/C5H8N4/c1-2-9-4-7-8-5(9)3-6-1/h4,6H,1-3H2; (3)InChIKey:UMEIYBJBGZKZOS-UHFFFAOYAI; (4)Std. InChI:InChI=1S/C5H8N4/c1-2-9-4-7-8-5(9)3-6-1/h4,6H,1-3H2; (5)Std. InChIKey:UMEIYBJBGZKZOS-UHFFFAOYSA-N.
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