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16341-50-7 | 2-Pyrimidinamine, 5-iodo-N-methyl-
CAS No: 16341-50-7 Catalog No: AG001U3Z MDL No:MFCD22369795
Product Description
Catalog Number:
AG001U3Z
Chemical Name:
2-Pyrimidinamine, 5-iodo-N-methyl-
CAS Number:
16341-50-7
Molecular Formula:
C5H6IN3
Molecular Weight:
235.0257
MDL Number:
MFCD22369795
IUPAC Name:
5-iodo-N-methylpyrimidin-2-amine
InChI:
InChI=1S/C5H6IN3/c1-7-5-8-2-4(6)3-9-5/h2-3H,1H3,(H,7,8,9)
InChI Key:
JNEAWFSSFYRAMO-UHFFFAOYSA-N
SMILES:
CNc1ncc(cn1)I
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:
234.961g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.028g/mol
Monoisotopic Mass:
234.961g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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