Home Other Building Blocks 1-(5-(4-(trifluoromethyl)phenyl)thiophen-2-yl)ethanone

1-(5-(4-(trifluoromethyl)phenyl)thiophen-2-yl)ethanone

CAS No.:
893735-21-2
Catalog Number:
AG00H2D6
Molecular Formula:
C13H9F3OS
Molecular Weight:
270.2702
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Product Description
Catalog Number:
AG00H2D6
Chemical Name:
1-(5-(4-(trifluoromethyl)phenyl)thiophen-2-yl)ethanone
CAS Number:
893735-21-2
Molecular Formula:
C13H9F3OS
Molecular Weight:
270.2702
MDL Number:
MFCD06802019
IUPAC Name:
1-[5-[4-(trifluoromethyl)phenyl]thiophen-2-yl]ethanone
InChI:
InChI=1S/C13H9F3OS/c1-8(17)11-6-7-12(18-11)9-2-4-10(5-3-9)13(14,15)16/h2-7H,1H3
InChI Key:
BJQZMUPNZWLRMA-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(s1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.033g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.269g/mol
Monoisotopic Mass:
270.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties