Home Other Building Blocks 6,6,6-trifluorohexan-2-one

6,6,6-trifluorohexan-2-one

CAS No.:
1501305-11-8
Catalog Number:
AG01ACFJ
Molecular Formula:
C6H9F3O
Molecular Weight:
154.1303
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Product Description
Catalog Number:
AG01ACFJ
Chemical Name:
6,6,6-trifluorohexan-2-one
CAS Number:
1501305-11-8
Molecular Formula:
C6H9F3O
Molecular Weight:
154.1303
MDL Number:
MFCD21923284
IUPAC Name:
6,6,6-trifluorohexan-2-one
InChI:
InChI=1S/C6H9F3O/c1-5(10)3-2-4-6(7,8)9/h2-4H2,1H3
InChI Key:
JEFZBEYZGIMZKV-UHFFFAOYSA-N
SMILES:
CC(=O)CCCC(F)(F)F
Properties
Complexity:
117  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.061g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.132g/mol
Monoisotopic Mass:
154.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties