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Home > Aldehydes > 1414870-67-9
1414870-67-9 | 4-bromo-2-fluoro-5-(trifluoromethyl)benzaldehyde
CAS No: 1414870-67-9 Catalog No: AG01BVEG MDL No:MFCD22628190
Product Description
Catalog Number:
AG01BVEG
Chemical Name:
4-bromo-2-fluoro-5-(trifluoromethyl)benzaldehyde
CAS Number:
1414870-67-9
Molecular Formula:
C8H3BrF4O
Molecular Weight:
271.0064
MDL Number:
MFCD22628190
IUPAC Name:
4-bromo-2-fluoro-5-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H3BrF4O/c9-6-2-7(10)4(3-14)1-5(6)8(11,12)13/h1-3H
InChI Key:
SYXXJSLVINTBHO-UHFFFAOYSA-N
SMILES:
O=Cc1cc(c(cc1F)Br)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:
3.5
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