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Home > Bromides > 1333146-86-3
1333146-86-3 | 2(1H)-Pyridinone, 5-bromo-1-methyl-3-(phenylmethoxy)-
CAS No: 1333146-86-3 Catalog No: AG0014M6 MDL No:MFCD22570466
Product Description
Catalog Number:
AG0014M6
Chemical Name:
2(1H)-Pyridinone, 5-bromo-1-methyl-3-(phenylmethoxy)-
CAS Number:
1333146-86-3
Molecular Formula:
C13H12BrNO2
Molecular Weight:
294.1439
MDL Number:
MFCD22570466
IUPAC Name:
5-bromo-1-methyl-3-phenylmethoxypyridin-2-one
InChI:
InChI=1S/C13H12BrNO2/c1-15-8-11(14)7-12(13(15)16)17-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3
InChI Key:
ARIKPCZRYQDZJY-UHFFFAOYSA-N
SMILES:
Brc1cc(OCc2ccccc2)c(=O)n(c1)C
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.005g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.148g/mol
Monoisotopic Mass:
293.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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