Home Other Building Blocks 1-(2,2-dimethylcyclopropyl)-2,2,2-trifluoroethan-1-one

1-(2,2-dimethylcyclopropyl)-2,2,2-trifluoroethan-1-one

CAS No.:
2091587-98-1
Catalog Number:
AG01DW6T
Molecular Formula:
C7H9F3O
Molecular Weight:
166.1410
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Product Description
Catalog Number:
AG01DW6T
Chemical Name:
1-(2,2-dimethylcyclopropyl)-2,2,2-trifluoroethan-1-one
CAS Number:
2091587-98-1
Molecular Formula:
C7H9F3O
Molecular Weight:
166.1410
MDL Number:
MFCD31629119
IUPAC Name:
1-(2,2-dimethylcyclopropyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C7H9F3O/c1-6(2)3-4(6)5(11)7(8,9)10/h4H,3H2,1-2H3
InChI Key:
FPGKEYDJRZDRGU-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)C1CC1(C)C
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.143g/mol
Monoisotopic Mass:
166.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties