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Home > Fluorides > 1147103-48-7
1147103-48-7 | Ethanone, 2,2,2-trifluoro-1-(2-pyrazinyl)-
CAS No: 1147103-48-7 Catalog No: AG000F2P MDL No:MFCD06657596
Product Description
Catalog Number:
AG000F2P
Chemical Name:
Ethanone, 2,2,2-trifluoro-1-(2-pyrazinyl)-
CAS Number:
1147103-48-7
Molecular Formula:
C6H3F3N2O
Molecular Weight:
176.0960
MDL Number:
MFCD06657596
IUPAC Name:
2,2,2-trifluoro-1-pyrazin-2-ylethanone
InChI:
InChI=1S/C6H3F3N2O/c7-6(8,9)5(12)4-3-10-1-2-11-4/h1-3H
InChI Key:
UYYMVPDMBZSBCQ-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1nccnc1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.098g/mol
Monoisotopic Mass:
176.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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