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Chemical ID: 7297423
Chemical ID:
7297423
Name [?]:
2-(3-acetylphenoxy)-N-(2-fluorophenyl)-acetamide
SMILES [?]:
CC(=O)c1cccc(c1)OCC(=O)Nc2ccccc2F
InChi [?]:
InChI=1/C16H14FNO3/c1-11(19)12-5-4-6-13(9-12)21-10-16(20)18-15-8-3-2-7-14(15)17/h2-9H,10H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,18,17,6,5,7,19,16,9,11,2,4,8,20,15,12,21,14,3,13,10/rA:21nCCOCCCCCCOCCONCCCCCCF/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s8;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H14FNO3 |
All Atoms: | 35 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.53493 |
Area: | 487.025 |
Solvation: | -5.64069 |
Coulombic: | -39.7745 |
Bond Count [?]
All: | 22 |
Single: | 14 |
Double: | 8 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 287.286 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 2.68 |
LogP (Chemaxon): | 1.67 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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