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117846-58-9 | 3,5-Dimethyl-2,6-dibromopyridine
CAS No: 117846-58-9 Catalog No: AG0033JI MDL No:MFCD00234283
Product Description
Catalog Number:
AG0033JI
Chemical Name:
3,5-Dimethyl-2,6-dibromopyridine
CAS Number:
117846-58-9
Molecular Formula:
C7H7Br2N
Molecular Weight:
264.9452
MDL Number:
MFCD00234283
IUPAC Name:
2,6-dibromo-3,5-dimethylpyridine
InChI:
InChI=1S/C7H7Br2N/c1-4-3-5(2)7(9)10-6(4)8/h3H,1-2H3
InChI Key:
ILHNZRHAVNCIFX-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(nc1Br)Br
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.892g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.948g/mol
Monoisotopic Mass:
262.895g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| 2,6-Dibromo-3,5-dimethylpyridine and 2,6-diiodo-3,5-dimethylpyridine. | Acta crystallographica. Section C, Crystal structure communications 20061001 |
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