Home Other Building Blocks 1-[5-(trifluoromethyl)thiophen-2-yl]ethan-1-one

1-[5-(trifluoromethyl)thiophen-2-yl]ethan-1-one

CAS No.:
1367959-32-7
Catalog Number:
AG01BILM
Molecular Formula:
C7H5F3OS
Molecular Weight:
194.1742
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Product Description
Catalog Number:
AG01BILM
Chemical Name:
1-[5-(trifluoromethyl)thiophen-2-yl]ethan-1-one
CAS Number:
1367959-32-7
Molecular Formula:
C7H5F3OS
Molecular Weight:
194.1742
MDL Number:
MFCD22060966
IUPAC Name:
1-[5-(trifluoromethyl)thiophen-2-yl]ethanone
InChI:
InChI=1S/C7H5F3OS/c1-4(11)5-2-3-6(12-5)7(8,9)10/h2-3H,1H3
InChI Key:
XJBFXBLFFYCAMG-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(s1)C(F)(F)F
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.001g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.171g/mol
Monoisotopic Mass:
194.001g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties