Home Other Building Blocks ethyl 3-cyclopropyl-3-oxo-2-(trifluoromethyl)propanoate

ethyl 3-cyclopropyl-3-oxo-2-(trifluoromethyl)propanoate

CAS No.:
1502216-04-7
Catalog Number:
AG01EJXE
Molecular Formula:
C9H11F3O3
Molecular Weight:
224.1770
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Product Description
Catalog Number:
AG01EJXE
Chemical Name:
ethyl 3-cyclopropyl-3-oxo-2-(trifluoromethyl)propanoate
CAS Number:
1502216-04-7
Molecular Formula:
C9H11F3O3
Molecular Weight:
224.1770
MDL Number:
MFCD21950564
IUPAC Name:
ethyl 2-(cyclopropanecarbonyl)-3,3,3-trifluoropropanoate
InChI:
InChI=1S/C9H11F3O3/c1-2-15-8(14)6(9(10,11)12)7(13)5-3-4-5/h5-6H,2-4H2,1H3
InChI Key:
HSPHTIKQUJLMOO-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(F)(F)F)C(=O)C1CC1
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.066g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.179g/mol
Monoisotopic Mass:
224.066g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties