Chemical ID: 6674606

Cc1ccc(c(c1)NC(=O)Oc2cccc(c2)C(F)(F)F)C
Chemical ID:
6674606
Name [?]:
[3-(trifluoromethyl)phenyl] (2,5-dimethylphenyl)aminoformate
SMILES [?]:
Cc1ccc(c(c1)NC(=O)Oc2cccc(c2)C(F)(F)F)C
InChi [?]:
InChI=1/C16H14F3NO2/c1-10-6-7-11(2)14(8-10)20-15(21)22-13-5-3-4-12(9-13)16(17,18)19/h3-9H,1-2H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,22,14,15,13,3,4,7,17,2,5,16,12,6,9,18,19,20,21,8,10,11/E:(17,18,19)/rA:22nCCCCCCCNCOOCCCCCCCFFFC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s18;s18;s18;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14F3NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.80177
Area:480.854
Solvation:-2.21958
Coulombic:-53.0655
Bond Count [?]
All:23
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:309.283
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.6
LogP (Chemaxon):5.5

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