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1072944-66-1 | 3-Bromo-6-fluoro-2-(trifluoromethyl);quinolin-4-ol
CAS No: 1072944-66-1 Catalog No: AG003J3L MDL No:MFCD11504911
Product Description
Catalog Number:
AG003J3L
Chemical Name:
3-Bromo-6-fluoro-2-(trifluoromethyl);quinolin-4-ol
CAS Number:
1072944-66-1
Molecular Formula:
C10H4BrF4NO
Molecular Weight:
310.0425
MDL Number:
MFCD11504911
IUPAC Name:
3-bromo-6-fluoro-2-(trifluoromethyl)-1H-quinolin-4-one
InChI:
InChI=1S/C10H4BrF4NO/c11-7-8(17)5-3-4(12)1-2-6(5)16-9(7)10(13,14)15/h1-3H,(H,16,17)
InChI Key:
MCCSZUCEZSMGAJ-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(O)c(c(n2)C(F)(F)F)Br
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.941g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
310.046g/mol
Monoisotopic Mass:
308.941g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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