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Home > Aldehydes > 1016797-05-9
1016797-05-9 | 3-(4-Cyano-2-fluorobenzyloxy)benzaldehyde
CAS No: 1016797-05-9 Catalog No: AG01FBFZ MDL No:
Product Description
Catalog Number:
AG01FBFZ
Chemical Name:
3-(4-Cyano-2-fluorobenzyloxy)benzaldehyde
CAS Number:
1016797-05-9
Molecular Formula:
C15H10FNO2
Molecular Weight:
255.2438
IUPAC Name:
3-fluoro-4-[(3-formylphenoxy)methyl]benzonitrile
InChI:
InChI=1S/C15H10FNO2/c16-15-7-11(8-17)4-5-13(15)10-19-14-3-1-2-12(6-14)9-18/h1-7,9H,10H2
InChI Key:
KMYXJZGNCOJIPD-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCc1ccc(cc1F)C#N
Properties
Complexity:
351
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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