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Home > Aldehydes > 1055176-30-1
1055176-30-1 | 6-BroMo-2-fluoro-3-(trifluoroMethyl)benzaldehyde
CAS No: 1055176-30-1 Catalog No: AG008VXF MDL No:MFCD16658656
Product Description
Catalog Number:
AG008VXF
Chemical Name:
6-BroMo-2-fluoro-3-(trifluoroMethyl)benzaldehyde
CAS Number:
1055176-30-1
Molecular Formula:
C8H3BrF4O
Molecular Weight:
271.0064
MDL Number:
MFCD16658656
IUPAC Name:
6-bromo-2-fluoro-3-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H3BrF4O/c9-6-2-1-5(8(11,12)13)7(10)4(6)3-14/h1-3H
InChI Key:
WEMMKWCCQNHYIO-UHFFFAOYSA-N
SMILES:
O=Cc1c(Br)ccc(c1F)C(F)(F)F
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.93g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.009g/mol
Monoisotopic Mass:
269.93g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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