Home Other Building Blocks 2,2-difluoro-1-[3-(propan-2-yloxy)phenyl]ethan-1-one

2,2-difluoro-1-[3-(propan-2-yloxy)phenyl]ethan-1-one

CAS No.:
1565091-61-3
Catalog Number:
AG01BGQ1
Molecular Formula:
C11H12F2O2
Molecular Weight:
214.2086
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Product Description
Catalog Number:
AG01BGQ1
Chemical Name:
2,2-difluoro-1-[3-(propan-2-yloxy)phenyl]ethan-1-one
CAS Number:
1565091-61-3
Molecular Formula:
C11H12F2O2
Molecular Weight:
214.2086
MDL Number:
MFCD26045131
IUPAC Name:
2,2-difluoro-1-(3-propan-2-yloxyphenyl)ethanone
InChI:
InChI=1S/C11H12F2O2/c1-7(2)15-9-5-3-4-8(6-9)10(14)11(12)13/h3-7,11H,1-2H3
InChI Key:
XPFCJUAZKFMTCN-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1)C(=O)C(F)F)C
Properties
Complexity:
217  
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:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties