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Home > Aldehydes > 356058-14-5
356058-14-5 | 6-(4-(Trifluoromethyl)phenyl)nicotinaldehyde
CAS No: 356058-14-5 Catalog No: AG007A8Z MDL No:MFCD04115430
Product Description
Catalog Number:
AG007A8Z
Chemical Name:
6-(4-(Trifluoromethyl)phenyl)nicotinaldehyde
CAS Number:
356058-14-5
Molecular Formula:
C13H8F3NO
Molecular Weight:
251.2039
MDL Number:
MFCD04115430
IUPAC Name:
6-[4-(trifluoromethyl)phenyl]pyridine-3-carbaldehyde
InChI:
InChI=1S/C13H8F3NO/c14-13(15,16)11-4-2-10(3-5-11)12-6-1-9(8-18)7-17-12/h1-8H
InChI Key:
ORGBUOFMDHPPIX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(nc1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.056g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.208g/mol
Monoisotopic Mass:
251.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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