Chemical ID: 6674925

c1cc(cc(c1)OC(=O)Nc2cccc(c2Cl)Cl)C(F)(F)F
Chemical ID:
6674925
Name [?]:
[3-(trifluoromethyl)phenyl] (2,3-dichlorophenyl)aminoformate
SMILES [?]:
c1cc(cc(c1)OC(=O)Nc2cccc(c2Cl)Cl)C(F)(F)F
InChi [?]:
InChI=1/C14H8Cl2F3NO2/c15-10-5-2-6-11(12(10)16)20-13(21)22-9-4-1-3-8(7-9)14(17,18)19/h1-7H,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,13,2,6,14,12,4,3,5,15,11,16,8,19,18,17,20,21,22,10,9,7/E:(17,18,19)/rA:22nCCCCCCOCONCCCCCCClClCFFF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s16;s15;s3;s19;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H8Cl2F3NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.3219
Area:497.415
Solvation:-2.11352
Coulombic:-53.879
Bond Count [?]
All:23
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:350.119
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.18
LogP (Chemaxon):5.6

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Descriptor Annotations

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