Home Other Building Blocks ETHYL (3,5-DIFLUOROBENZOYL)ACETATE

ETHYL (3,5-DIFLUOROBENZOYL)ACETATE

CAS No.:
359424-42-3
Catalog Number:
AG00CAFE
Molecular Formula:
C11H10F2O3
Molecular Weight:
228.1921
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Product Description
Catalog Number:
AG00CAFE
Chemical Name:
ETHYL (3,5-DIFLUOROBENZOYL)ACETATE
CAS Number:
359424-42-3
Molecular Formula:
C11H10F2O3
Molecular Weight:
228.1921
MDL Number:
MFCD07783525
IUPAC Name:
ethyl 3-(3,5-difluorophenyl)-3-oxopropanoate
InChI:
InChI=1S/C11H10F2O3/c1-2-16-11(15)6-10(14)7-3-8(12)5-9(13)4-7/h3-5H,2,6H2,1H3
InChI Key:
SJQAWRHMPXRCRM-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(=O)c1cc(F)cc(c1)F
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.06g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.195g/mol
Monoisotopic Mass:
228.06g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties