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Home > Bromides > 1187168-77-9
1187168-77-9 | 3-(4-Bromobenzoyl)-4-methylpyridine
CAS No: 1187168-77-9 Catalog No: AG01FDSI MDL No:
Product Description
Catalog Number:
AG01FDSI
Chemical Name:
3-(4-Bromobenzoyl)-4-methylpyridine
CAS Number:
1187168-77-9
Molecular Formula:
C13H10BrNO
Molecular Weight:
276.1286
IUPAC Name:
(4-bromophenyl)-(4-methylpyridin-3-yl)methanone
InChI:
InChI=1S/C13H10BrNO/c1-9-6-7-15-8-12(9)13(16)10-2-4-11(14)5-3-10/h2-8H,1H3
InChI Key:
WLFRKVVZYLXHHS-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=O)c1cnccc1C
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.995g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.133g/mol
Monoisotopic Mass:
274.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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