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Home > Fluorides > 762240-92-6
762240-92-6 | 3-(Trifluoromethyl)-5,6,7,8-Tetrahydro-[1,2,4]Triazolo[4,3-a]Pyrazine Hydrochloride
CAS No: 762240-92-6 Catalog No: AG0033H6 MDL No:MFCD09817638
Product Description
Catalog Number:
AG0033H6
Chemical Name:
3-(Trifluoromethyl)-5,6,7,8-Tetrahydro-[1,2,4]Triazolo[4,3-a]Pyrazine Hydrochloride
CAS Number:
762240-92-6
Molecular Formula:
C6H8ClF3N4
Molecular Weight:
228.6027
MDL Number:
MFCD09817638
IUPAC Name:
3-(trifluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine;hydrochloride
InChI:
InChI=1S/C6H7F3N4.ClH/c7-6(8,9)5-12-11-4-3-10-1-2-13(4)5;/h10H,1-3H2;1H
InChI Key:
AQCSCRYRCRORET-UHFFFAOYSA-N
SMILES:
FC(c1nnc2n1CCNC2)(F)F.Cl
EC Number:
616-309-4
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.039g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.603g/mol
Monoisotopic Mass:
228.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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