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Chemical ID: 7521281

c1ccc(c(c1)OCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)Cl

Chemical ID:

7521281

Name [?]:

N-[3,5-bis(trifluoromethyl)phenyl]-2-(2-chlorophenoxy)-acetamide

SMILES [?]:

c1ccc(c(c1)OCC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)Cl

InChi [?]:

InChI=1/C16H10ClF6NO2/c17-12-3-1-2-4-13(12)26-8-14(25)24-11-6-9(15(18,19)20)5-10(7-11)16(21,22)23/h1-7H,8H2,(H,24,25)

InChi Info:

AuxInfo=1/1/N:2,1,3,6,15,13,17,8,14,16,12,4,5,9,22,18,26,23,24,25,19,20,21,11,10,7/E:(6,7)(9,10)(15,16)(18,19,20,21,22,23)/rA:26nCCCCCCOCCONCCCCCCCFFFCFFFCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;s18;s18;s18;s14;s22;s22;s22;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₆H₁₀ClF₆NO₂
All Atoms:	36
Heavy Atoms:	26
Chiral Atoms:	None

ZAP Information [?]

Total:	7.61574
Area:	542.038
Solvation:	-5.93521
Coulombic:	-64.7072

Bond Count [?]

All:	27
Single:	20
Double:	7
Rotors:	7
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.15
LogP (Chemaxon):	None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value