Chemical ID: 6670301

c1ccc(c(c1)OCC(=O)Nc2cccc(c2)C(F)(F)F)Cl
Chemical ID:
6670301
Name [?]:
2-(2-chlorophenoxy)-N-[3-(trifluoromethyl)phenyl]-acetamide
SMILES [?]:
c1ccc(c(c1)OCC(=O)Nc2cccc(c2)C(F)(F)F)Cl
InChi [?]:
InChI=1/C15H11ClF3NO2/c16-12-6-1-2-7-13(12)22-9-14(21)20-11-5-3-4-10(8-11)15(17,18)19/h1-8H,9H2,(H,20,21)
InChi Info:
AuxInfo=1/1/N:2,1,14,15,13,3,6,17,8,16,12,4,5,9,18,22,19,20,21,11,10,7/E:(17,18,19)/rA:22nCCCCCCOCCONCCCCCCCFFFCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s18;s18;s18;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11ClF3NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.45784
Area:496.108
Solvation:-4.94487
Coulombic:-47.5865
Bond Count [?]
All:23
Single:16
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:329.701
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.22
LogP (Chemaxon):4.28

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