- 3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
- 3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride
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Cas Database |
| Name |
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine |
EINECS | 207-753-6 |
| CAS No. | 486460-21-3 | Density | 1.729 g/cm3 |
| PSA | 42.74000 | LogP | 0.72890 |
| Solubility | N/A | Melting Point |
236-246oC |
| Formula | C6H7F3N4 | Boiling Point | 266.153 °C at 760 mmHg |
| Molecular Weight | 192.144 | Flash Point | 114.766 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
3-Trifluoromethyl-5,6-dihydro-8H-[1,2,4]triazolo[4,3-a]pyrazine;1,2,4-Triazolo[4,3-a]pyrazine,5,6,7,8-tetrahydro-3-(trifluoromethyl)-; |
Article Data | 17 |
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine Chemical Properties
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Systematic Name: 3-(Trifluoromethyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine
SMILES: FC(F)(F)c1nnc2n1CCNC2
InChI: InChI=1/C6H7F3N4/c7-6(8,9)5-12-11-4-3-10-1-2-13(4)5/h10H,1-3H2
InChIKey: FMTDZGCPYKWMPT-UHFFFAOYAE
Molecular Formula: C6H7F3N4
Molecular Weight: 192.14
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 0
Index of Refraction: 1.607
Molar Refractivity: 38.358 cm3
Molar Volume: 111.126 cm3
Surface Tension: 43.402 dyne/cm
Density: 1.729 g/cm3
Flash Point: 114.766 °C
Enthalpy of Vaporization: 50.412 kJ/mol
Boiling Point: 266.153 °C at 760 mmHg
Vapour Pressure: 0.009 mmHg at 25 °C
Product Categories of 3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride (CAS NO.486460-21-3): Amines and Anilines; Heterocycles; Heterocyclic Building Blocks
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine Safety Profile
Hazard Codes: 
Xi
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine Specification
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrochloride (CAS NO.486460-21-3), its Synonyms are TAP-4 (Sitagliptin Intermediate) ; 3-Trifluoro methyl-[1,2,4]triazole[4,3-a]piperazine ; 1,2,4-Triazolo[4,3-a]pyrazine, 5,6,7,8-tetrahydro-3-(trifluoromethyl)- .
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