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Chemical ID: 7284810
Chemical ID:
7284810
Name [?]:
N-[4-[(3-fluoro-4-methoxy-phenyl)methoxy]phenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)OCc2ccc(c(c2)F)OC
InChi [?]:
InChI=1/C16H16FNO3/c1-11(19)18-13-4-6-14(7-5-13)21-10-12-3-8-16(20-2)15(17)9-12/h3-9H,10H2,1-2H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,21,14,6,10,7,9,15,18,12,2,13,5,8,17,16,19,4,3,20,11/E:(4,5)(6,7)/rA:21nCCONCCCCCCOCCCCCCCFOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;s12;s13;d14;s15;d16;d13s17;s17;s16;s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H16FNO3 |
All Atoms: | 37 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.31039 |
Area: | 490.656 |
Solvation: | -5.95602 |
Coulombic: | -37.9625 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 289.302 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 2.98 |
LogP (Chemaxon): | 2.78 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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