Home Other Building Blocks 4-[4-(difluoromethoxy)phenyl]butan-2-one

4-[4-(difluoromethoxy)phenyl]butan-2-one

CAS No.:
733044-93-4
Catalog Number:
AG019HXG
Molecular Formula:
C11H12F2O2
Molecular Weight:
214.2086
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Product Description
Catalog Number:
AG019HXG
Chemical Name:
4-[4-(difluoromethoxy)phenyl]butan-2-one
CAS Number:
733044-93-4
Molecular Formula:
C11H12F2O2
Molecular Weight:
214.2086
MDL Number:
MFCD03980990
IUPAC Name:
4-[4-(difluoromethoxy)phenyl]butan-2-one
InChI:
InChI=1S/C11H12F2O2/c1-8(14)2-3-9-4-6-10(7-5-9)15-11(12)13/h4-7,11H,2-3H2,1H3
InChI Key:
ABLIXIYSRZALED-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1)CCC(=O)C)F
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.081g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.212g/mol
Monoisotopic Mass:
214.081g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties