Chemical ID: 7667746

Cc1cc(nn1CC(C)C(=O)O)C(F)(F)F
Chemical ID:
7667746
Name [?]:
None
SMILES [?]:
Cc1cc(nn1CC(C)C(=O)O)C(F)(F)F
InChi [?]:
InChI=1/C9H11F3N2O2/c1-5(8(15)16)4-14-6(2)3-7(13-14)9(10,11)12/h3,5H,4H2,1-2H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:9,1,3,7,8,2,4,10,13,14,15,16,5,6,11,12/E:(10,11,12)(15,16)/rA:16cCCCCNNCCCCOOCFFF/rB:s1;d2;s3;d4;s2s5;s6;s7;s8;s8;d10;s10;s4;s13;s13;s13;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H11F3N2O2
All Atoms:27
Heavy Atoms:16
Chiral Atoms:None
ZAP Information [?]
Total:6.74289
Area:383.825
Solvation:-2.85274
Coulombic:-49.3623
Bond Count [?]
All:16
Single:13
Double:3
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.51
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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