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1228108-74-4 | Benzenamine, 2-bromo-6-chloro-4-(trifluoromethoxy)-
CAS No: 1228108-74-4 Catalog No: AG000JIM MDL No:MFCD16618925
Product Description
Catalog Number:
AG000JIM
Chemical Name:
Benzenamine, 2-bromo-6-chloro-4-(trifluoromethoxy)-
CAS Number:
1228108-74-4
Molecular Formula:
C7H4BrClF3NO
Molecular Weight:
290.4650
MDL Number:
MFCD16618925
IUPAC Name:
2-bromo-6-chloro-4-(trifluoromethoxy)aniline
InChI:
InChI=1S/C7H4BrClF3NO/c8-4-1-3(14-7(10,11)12)2-5(9)6(4)13/h1-2H,13H2
InChI Key:
DIHNAXVPGYEEIO-UHFFFAOYSA-N
SMILES:
Clc1cc(cc(c1N)Br)OC(F)(F)F
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.912g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.464g/mol
Monoisotopic Mass:
288.912g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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