Home Other Building Blocks 4,4-difluoro-3,3-dimethylbutan-2-one

4,4-difluoro-3,3-dimethylbutan-2-one

CAS No.:
2031260-77-0
Catalog Number:
AG01B71T
Molecular Formula:
C6H10F2O
Molecular Weight:
136.1398
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Product Description
Catalog Number:
AG01B71T
Chemical Name:
4,4-difluoro-3,3-dimethylbutan-2-one
CAS Number:
2031260-77-0
Molecular Formula:
C6H10F2O
Molecular Weight:
136.1398
MDL Number:
MFCD30345044
IUPAC Name:
4,4-difluoro-3,3-dimethylbutan-2-one
InChI:
InChI=1S/C6H10F2O/c1-4(9)6(2,3)5(7)8/h5H,1-3H3
InChI Key:
UDZHGMYHOSYFFC-UHFFFAOYSA-N
SMILES:
FC(C(C(=O)C)(C)C)F
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.07g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.142g/mol
Monoisotopic Mass:
136.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties