3-[3-(trifluoromethyl)phenyl]benzaldehyde


Chemical Name: 3-[3-(trifluoromethyl)phenyl]benzaldehyde
CAS Number: 126091-24-5
Product Number: AG000RM7(AGN-PC-0K4N9S)
Synonyms:
MDL No:
Molecular Formula: C14H9F3O
Molecular Weight: 250.2159

Identification/Properties


Computed Properties
Molecular Weight:
250.22g/mol
XLogP3:
4.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
250.061g/mol
Monoisotopic Mass:
250.061g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
287
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P261-P280-P305+P351+P338-P304+P340-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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