Organofluorine / Alfa Chemistry
2-Fluoropyrimidin-4-amine

2-Fluoropyrimidin-4-amine

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2-Fluoropyrimidin-4-amine
Catalog OFC96548913
CAS 96548-91-3
Category Fluorinated Pyrimidines
Synonyms 4-amino-2-fluoropyrimidine
Purity 97%
MDL Number MFCD00769380
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 2-fluoropyrimidin-4-amine
InChI InChI=1S/C4H4FN3/c5-4-7-2-1-3(6)8-4/h1-2H,(H2,6,7,8)
InChI Key SPWJNWKKNZWCPA-UHFFFAOYSA-N
Isomeric SMILES C1=CN=C(N=C1N)F
Molecular Formula C4H4FN3
Molecular Weight 113.09
Storage Keep in dark place, inert atmosphere, 2-8 °C
XLogP3-AA 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 113.03892530 g/mol
Monoisotopic Mass 113.03892530 g/mol
Topological Polar Surface Area 51.8Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 77.7

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