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Chemical ID: 4324445
Chemical ID:
4324445
Name [?]:
N-(2,4-difluorophenyl)-2-(2,4-dimethylphenoxy)-acetamide
SMILES [?]:
Cc1ccc(c(c1)C)OCC(=O)Nc2ccc(cc2F)F
InChi [?]:
InChI=1/C16H15F2NO2/c1-10-3-6-15(11(2)7-10)21-9-16(20)19-14-5-4-12(17)8-13(14)18/h3-8H,9H2,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,8,3,16,15,4,7,18,10,2,6,17,19,14,5,11,21,20,13,12,9/rA:21nCCCCCCCCOCCONCCCCCCFF/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H15F2NO2 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.95677 |
Area: | 476.185 |
Solvation: | -4.94785 |
Coulombic: | -35.5913 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 291.293 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 3.66 |
LogP (Chemaxon): | 3.44 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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