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Chemical ID: 7675576
Chemical ID:
7675576
Name [?]:
None
SMILES [?]:
c1cc(cc(c1)F)C(=O)Nc2cccc(c2O)C(=O)O
InChi [?]:
InChI=1/C14H10FNO4/c15-9-4-1-3-8(7-9)13(18)16-11-6-2-5-10(12(11)17)14(19)20/h1-7,17H,(H,16,18)(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,13,2,6,14,12,4,3,5,15,11,16,8,18,7,10,17,9,19,20/E:(19,20)/rA:20nCCCCCCFCONCCCCCCOCOO/rB:s1;d2;s3;d4;d1s5;s5;s3;d8;s8;s10;s11;d12;s13;d14;d11s15;s16;s15;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H10FNO4 |
All Atoms: | 30 |
Heavy Atoms: | 20 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 6.88451 |
Area: | 443.404 |
Solvation: | -4.20059 |
Coulombic: | -68.7077 |
Bond Count [?]
All: | 21 |
Single: | 13 |
Double: | 8 |
Rotors: | 4 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.78 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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