Home Other Building Blocks 3-(4-fluorophenyl)-3-methyloxolane-2,5-dione

3-(4-fluorophenyl)-3-methyloxolane-2,5-dione

CAS No.:
98054-67-2
Catalog Number:
AG01BFOU
Molecular Formula:
C11H9FO3
Molecular Weight:
208.1858
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Product Description
Catalog Number:
AG01BFOU
Chemical Name:
3-(4-fluorophenyl)-3-methyloxolane-2,5-dione
CAS Number:
98054-67-2
Molecular Formula:
C11H9FO3
Molecular Weight:
208.1858
MDL Number:
MFCD11134351
IUPAC Name:
3-(4-fluorophenyl)-3-methyloxolane-2,5-dione
InChI:
InChI=1S/C11H9FO3/c1-11(6-9(13)15-10(11)14)7-2-4-8(12)5-3-7/h2-5H,6H2,1H3
InChI Key:
FIGPBBMFLYOGKB-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)CC1(C)c1ccc(cc1)F
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.054g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.188g/mol
Monoisotopic Mass:
208.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties