Chemical ID: 5194688

COc1ccc(cc1)OC(=O)Nc2ccccc2C(F)(F)F
Chemical ID:
5194688
Name [?]:
(4-methoxyphenyl) [2-(trifluoromethyl)phenyl]aminoformate
SMILES [?]:
COc1ccc(cc1)OC(=O)Nc2ccccc2C(F)(F)F
InChi [?]:
InChI=1/C15H12F3NO3/c1-21-10-6-8-11(9-7-10)22-14(20)19-13-5-3-2-4-12(13)15(16,17)18/h2-9H,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,16,15,17,14,4,8,5,7,3,6,18,13,10,19,20,21,22,12,11,2,9/E:(6,7)(8,9)(16,17,18)/rA:22nCOCCCCCCOCONCCCCCCCFFF/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s19;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12F3NO3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.46036
Area:470.434
Solvation:-3.30049
Coulombic:-59.8892
Bond Count [?]
All:23
Single:16
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:311.256
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.85
LogP (Chemaxon):4.31

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