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111982-45-7 | 2-Fluorophenyl cyclopentyl ketone
CAS No: 111982-45-7 Catalog No: AG00367V MDL No:MFCD03841320
Product Description
Catalog Number:
AG00367V
Chemical Name:
2-Fluorophenyl cyclopentyl ketone
CAS Number:
111982-45-7
Molecular Formula:
C12H13FO
Molecular Weight:
192.2294
MDL Number:
MFCD03841320
IUPAC Name:
cyclopentyl-(2-fluorophenyl)methanone
InChI:
InChI=1S/C12H13FO/c13-11-8-4-3-7-10(11)12(14)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2
InChI Key:
SAVZOQLBNNRMNY-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1F)C1CCCC1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.233g/mol
Monoisotopic Mass:
192.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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