Benzaldehyde, 4-bromo-3-(trifluoromethyl)-


Chemical Name: Benzaldehyde, 4-bromo-3-(trifluoromethyl)-
CAS Number: 34328-47-7
Product Number: AG00BXY0(AGN-PC-0NI0ZM)
Synonyms:
MDL No:
Molecular Formula: C8H4BrF3O
Molecular Weight: 253.0160

Identification/Properties


Computed Properties
Molecular Weight:
253.018g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
251.94g/mol
Monoisotopic Mass:
251.94g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
192
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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