Chemical ID: 4116781

C(=O)(C(F)(F)F)C(F)(F)F
Chemical ID:
4116781
Name [?]:
1,1,1,3,3,3-hexafluoropropan-2-one
SMILES [?]:
C(=O)(C(F)(F)F)C(F)(F)F
InChi [?]:
InChI=1/C3F6O/c4-2(5,6)1(10)3(7,8)9
InChi Info:
AuxInfo=1/0/N:1,3,7,4,5,6,8,9,10,2/E:(2,3)(4,5,6,7,8,9)/rA:10nCOCFFFCFFF/rB:d1;s1;s3;s3;s3;s1;s7;s7;s7;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C3F6O
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:3.37474
Area:236.047
Solvation:-2.52643
Coulombic:-45.3765
Bond Count [?]
All:9
Single:8
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:166.022
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.76
LogP (Chemaxon):2.6

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Experimental Annotations

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Descriptor Annotations

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