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1443353-42-1 | 4'-n-Propyl-2,2,3,3,3-pentafluoropropiophenone
CAS No: 1443353-42-1 Catalog No: AG01FA51 MDL No:
Product Description
Catalog Number:
AG01FA51
Chemical Name:
4'-n-Propyl-2,2,3,3,3-pentafluoropropiophenone
CAS Number:
1443353-42-1
Molecular Formula:
C12H11F5O
Molecular Weight:
266.2072
IUPAC Name:
2,2,3,3,3-pentafluoro-1-(4-propylphenyl)propan-1-one
InChI:
InChI=1S/C12H11F5O/c1-2-3-8-4-6-9(7-5-8)10(18)11(13,14)12(15,16)17/h4-7H,2-3H2,1H3
InChI Key:
RBXIZMMZTLSSRP-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)C(=O)C(C(F)(F)F)(F)F
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.073g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.211g/mol
Monoisotopic Mass:
266.073g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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