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150322-75-1 | 1-(2-Fluorophenyl)butan-2-one
CAS No: 150322-75-1 Catalog No: AG01EU85 MDL No:
Product Description
Catalog Number:
AG01EU85
Chemical Name:
1-(2-Fluorophenyl)butan-2-one
CAS Number:
150322-75-1
Molecular Formula:
C10H11FO
Molecular Weight:
166.1921
IUPAC Name:
1-(2-fluorophenyl)butan-2-one
InChI:
InChI=1S/C10H11FO/c1-2-9(12)7-8-5-3-4-6-10(8)11/h3-6H,2,7H2,1H3
InChI Key:
HPIQZKPBRZHYHR-UHFFFAOYSA-N
SMILES:
CCC(=O)Cc1ccccc1F
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.195g/mol
Monoisotopic Mass:
166.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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