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1249509-28-1

1249509-28-1 | 3',4',5'-Trifluoro-2-methylpropiophenone

CAS No: 1249509-28-1 Catalog No: AG01FBXG MDL No:

Product Description

Catalog Number:
AG01FBXG
Chemical Name:
3',4',5'-Trifluoro-2-methylpropiophenone
CAS Number:
1249509-28-1
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
IUPAC Name:
2-methyl-1-(3,4,5-trifluorophenyl)propan-1-one
InChI:
InChI=1S/C10H9F3O/c1-5(2)10(14)6-3-7(11)9(13)8(12)4-6/h3-5H,1-2H3
InChI Key:
NZWUQTAVWPFJKT-UHFFFAOYSA-N
SMILES:
CC(C(=O)c1cc(F)c(c(c1)F)F)C

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.176g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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