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Home > Aldehydes > 1016861-61-2
1016861-61-2 | 4-(4-Cyano-2-fluorobenzyloxy)benzaldehyde
CAS No: 1016861-61-2 Catalog No: AG01FBG0 MDL No:
Product Description
Catalog Number:
AG01FBG0
Chemical Name:
4-(4-Cyano-2-fluorobenzyloxy)benzaldehyde
CAS Number:
1016861-61-2
Molecular Formula:
C15H10FNO2
Molecular Weight:
255.2438
IUPAC Name:
3-fluoro-4-[(4-formylphenoxy)methyl]benzonitrile
InChI:
InChI=1S/C15H10FNO2/c16-15-7-12(8-17)1-4-13(15)10-19-14-5-2-11(9-18)3-6-14/h1-7,9H,10H2
InChI Key:
DGCPHKXNPPUVDD-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)OCc1ccc(cc1F)C#N
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.07g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.248g/mol
Monoisotopic Mass:
255.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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