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Home > Aldehydes > 886851-50-9
886851-50-9 | Benzaldehyde,2-(4-morpholinyl)-5-(trifluoromethyl)-
CAS No: 886851-50-9 Catalog No: AG0047UM MDL No:MFCD09025884
Product Description
Catalog Number:
AG0047UM
Chemical Name:
Benzaldehyde,2-(4-morpholinyl)-5-(trifluoromethyl)-
CAS Number:
886851-50-9
Molecular Formula:
C12H12F3NO2
Molecular Weight:
259.2244
MDL Number:
MFCD09025884
IUPAC Name:
2-morpholin-4-yl-5-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C12H12F3NO2/c13-12(14,15)10-1-2-11(9(7-10)8-17)16-3-5-18-6-4-16/h1-2,7-8H,3-6H2
InChI Key:
DIQGXZKPOSSQDH-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1N1CCOCC1)C(F)(F)F
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.082g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.228g/mol
Monoisotopic Mass:
259.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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