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1542317-08-7 | 3-(4-Iodophenoxy)cyclobutan-1-one
CAS No: 1542317-08-7 Catalog No: AG019GEE MDL No:MFCD21755833
Product Description
Catalog Number:
AG019GEE
Chemical Name:
3-(4-Iodophenoxy)cyclobutan-1-one
CAS Number:
1542317-08-7
Molecular Formula:
C10H9IO2
Molecular Weight:
288.0817
MDL Number:
MFCD21755833
IUPAC Name:
3-(4-iodophenoxy)cyclobutan-1-one
InChI:
InChI=1S/C10H9IO2/c11-7-1-3-9(4-2-7)13-10-5-8(12)6-10/h1-4,10H,5-6H2
InChI Key:
GSPKXTCWBHTIMI-UHFFFAOYSA-N
SMILES:
O=C1CC(C1)Oc1ccc(cc1)I
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.965g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.084g/mol
Monoisotopic Mass:
287.965g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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