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Home > Bromides > 1242252-07-8
1242252-07-8 | 1-Bromo-4-fluoro-2-(trifluoromethoxy)benzene
CAS No: 1242252-07-8 Catalog No: AG01ER7B MDL No:MFCD25458129
Product Description
Catalog Number:
AG01ER7B
Chemical Name:
1-Bromo-4-fluoro-2-(trifluoromethoxy)benzene
CAS Number:
1242252-07-8
Molecular Formula:
C7H3BrF4O
Molecular Weight:
258.9957
MDL Number:
MFCD25458129
IUPAC Name:
1-bromo-4-fluoro-2-(trifluoromethoxy)benzene
InChI:
InChI=1S/C7H3BrF4O/c8-5-2-1-4(9)3-6(5)13-7(10,11)12/h1-3H
InChI Key:
XGCQEUWGRZELMX-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)OC(F)(F)F)Br
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.93g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.998g/mol
Monoisotopic Mass:
257.93g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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