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163082-52-8 | 2-Pyrimidinamine, 5-fluoro-N-methyl-
CAS No: 163082-52-8 Catalog No: AG001TOW MDL No:MFCD18816624
Product Description
Catalog Number:
AG001TOW
Chemical Name:
2-Pyrimidinamine, 5-fluoro-N-methyl-
CAS Number:
163082-52-8
Molecular Formula:
C5H6FN3
Molecular Weight:
127.1196
MDL Number:
MFCD18816624
IUPAC Name:
5-fluoro-N-methylpyrimidin-2-amine
InChI:
InChI=1S/C5H6FN3/c1-7-5-8-2-4(6)3-9-5/h2-3H,1H3,(H,7,8,9)
InChI Key:
DNPBNIAEPZLPGJ-UHFFFAOYSA-N
SMILES:
CNc1ncc(cn1)F
Properties
Complexity:
80.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.055g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
127.122g/mol
Monoisotopic Mass:
127.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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