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1280786-64-2 | 2-Pyridinamine, 3-bromo-N-(1,1-dimethylethyl)-5-(trifluoromethyl)-
CAS No: 1280786-64-2 Catalog No: AG000XRY MDL No:MFCD18783203
Product Description
Catalog Number:
AG000XRY
Chemical Name:
2-Pyridinamine, 3-bromo-N-(1,1-dimethylethyl)-5-(trifluoromethyl)-
CAS Number:
1280786-64-2
Molecular Formula:
C10H12BrF3N2
Molecular Weight:
297.1149
MDL Number:
MFCD18783203
IUPAC Name:
3-bromo-N-tert-butyl-5-(trifluoromethyl)pyridin-2-amine
InChI:
InChI=1S/C10H12BrF3N2/c1-9(2,3)16-8-7(11)4-6(5-15-8)10(12,13)14/h4-5H,1-3H3,(H,15,16)
InChI Key:
ZVWGZFFDFKLWAS-UHFFFAOYSA-N
SMILES:
Brc1cc(cnc1NC(C)(C)C)C(F)(F)F
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.014g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.119g/mol
Monoisotopic Mass:
296.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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