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884602-82-8 | 4-(pentafluoroethyl)benzaldehyde
CAS No: 884602-82-8 Catalog No: AG01DWSC MDL No:MFCD16987733
Product Description
Catalog Number:
AG01DWSC
Chemical Name:
4-(pentafluoroethyl)benzaldehyde
CAS Number:
884602-82-8
Molecular Formula:
C9H5F5O
Molecular Weight:
224.1274
MDL Number:
MFCD16987733
IUPAC Name:
4-(1,1,2,2,2-pentafluoroethyl)benzaldehyde
InChI:
InChI=1S/C9H5F5O/c10-8(11,9(12,13)14)7-3-1-6(5-15)2-4-7/h1-5H
InChI Key:
HZUOUAVIYNXFBB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C(C(F)(F)F)(F)F
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.13g/mol
Monoisotopic Mass:
224.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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