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Home > Bromides > 1215205-40-5
1215205-40-5 | 2(1H)-Pyridinone, 3-bromo-1-(1-methylethyl)-5-(trifluoromethyl)-
CAS No: 1215205-40-5 Catalog No: AG00155V MDL No:MFCD15143622
Product Description
Catalog Number:
AG00155V
Chemical Name:
2(1H)-Pyridinone, 3-bromo-1-(1-methylethyl)-5-(trifluoromethyl)-
CAS Number:
1215205-40-5
Molecular Formula:
C9H9BrF3NO
Molecular Weight:
284.0731
MDL Number:
MFCD15143622
IUPAC Name:
3-bromo-1-propan-2-yl-5-(trifluoromethyl)pyridin-2-one
InChI:
InChI=1S/C9H9BrF3NO/c1-5(2)14-4-6(9(11,12)13)3-7(10)8(14)15/h3-5H,1-2H3
InChI Key:
SWDPZMKSKVHXJZ-UHFFFAOYSA-N
SMILES:
Brc1cc(cn(c1=O)C(C)C)C(F)(F)F
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.982g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.076g/mol
Monoisotopic Mass:
282.982g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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