Home Aldehydes 3-fluoro-4-(2,2,2-trifluoroethoxy)benzaldehyde

3-fluoro-4-(2,2,2-trifluoroethoxy)benzaldehyde

CAS No.:
502486-73-9
Catalog Number:
AG01A6ZA
Molecular Formula:
C9H6F4O2
Molecular Weight:
222.1364
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Product Description
Catalog Number:
AG01A6ZA
Chemical Name:
3-fluoro-4-(2,2,2-trifluoroethoxy)benzaldehyde
CAS Number:
502486-73-9
Molecular Formula:
C9H6F4O2
Molecular Weight:
222.1364
MDL Number:
MFCD11156439
IUPAC Name:
3-fluoro-4-(2,2,2-trifluoroethoxy)benzaldehyde
InChI:
InChI=1S/C9H6F4O2/c10-7-3-6(4-14)1-2-8(7)15-5-9(11,12)13/h1-4H,5H2
InChI Key:
KEWFAWZOPQSONO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)OCC(F)(F)F
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.03g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.139g/mol
Monoisotopic Mass:
222.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties