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Home > Fluorides > 1339769-34-4
1339769-34-4 | 2,6-Difluorophenyl cyclopentyl ketone
CAS No: 1339769-34-4 Catalog No: AG01FD0X MDL No:
Product Description
Catalog Number:
AG01FD0X
Chemical Name:
2,6-Difluorophenyl cyclopentyl ketone
CAS Number:
1339769-34-4
Molecular Formula:
C12H12F2O
Molecular Weight:
210.2199
IUPAC Name:
cyclopentyl-(2,6-difluorophenyl)methanone
InChI:
InChI=1S/C12H12F2O/c13-9-6-3-7-10(14)11(9)12(15)8-4-1-2-5-8/h3,6-8H,1-2,4-5H2
InChI Key:
SFXRDNOLUFUFRW-UHFFFAOYSA-N
SMILES:
O=C(c1c(F)cccc1F)C1CCCC1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.086g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.224g/mol
Monoisotopic Mass:
210.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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