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1443312-96-6 | 3'-n-Butoxy-5'-fluoroacetophenone
CAS No: 1443312-96-6 Catalog No: AG01FEG4 MDL No:
Product Description
Catalog Number:
AG01FEG4
Chemical Name:
3'-n-Butoxy-5'-fluoroacetophenone
CAS Number:
1443312-96-6
Molecular Formula:
C12H15FO2
Molecular Weight:
210.2447
IUPAC Name:
1-(3-butoxy-5-fluorophenyl)ethanone
InChI:
InChI=1S/C12H15FO2/c1-3-4-5-15-12-7-10(9(2)14)6-11(13)8-12/h6-8H,3-5H2,1-2H3
InChI Key:
OFKSONNRZAOYGS-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(F)cc(c1)C(=O)C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.248g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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