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16879-40-6 | Pyrimidine, 2-iodo-4,6-dimethyl-
CAS No: 16879-40-6 Catalog No: AG001YB0 MDL No:MFCD09909561
Product Description
Catalog Number:
AG001YB0
Chemical Name:
Pyrimidine, 2-iodo-4,6-dimethyl-
CAS Number:
16879-40-6
Molecular Formula:
C6H7IN2
Molecular Weight:
234.0376
MDL Number:
MFCD09909561
IUPAC Name:
2-iodo-4,6-dimethylpyrimidine
InChI:
InChI=1S/C6H7IN2/c1-4-3-5(2)9-6(7)8-4/h3H,1-2H3
InChI Key:
HYQMOIDHGGDJMH-UHFFFAOYSA-N
SMILES:
Cc1cc(C)nc(n1)I
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.965g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.04g/mol
Monoisotopic Mass:
233.965g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| 2-(1H-Imidazol-1-yl)-4,6-dimethyl-pyrimidine. | Acta crystallographica. Section E, Structure reports online 20111101 |
| 4,6-Dimethyl-2-(naphthalen-1-yl)pyrimidine. | Acta crystallographica. Section E, Structure reports online 20110801 |
| 2-Iodo-4,6-dimethyl-pyrimidine. | Acta crystallographica. Section E, Structure reports online 20100301 |
| 4,6-Dimethyl-2-p-tolyl-pyrimidine. | Acta crystallographica. Section E, Structure reports online 20091101 |
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