Chemical ID: 4121639

c1cc2c(cc1F)c(c(cn2)C(=O)O)O
Chemical ID:
4121639
Name [?]:
6-fluoro-4-hydroxy-quinoline-3-carboxylic acid
SMILES [?]:
c1cc2c(cc1F)c(c(cn2)C(=O)O)O
InChi [?]:
InChI=1/C10H6FNO3/c11-5-1-2-8-6(3-5)9(13)7(4-12-8)10(14)15/h1-4H,(H,12,13)(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,5,10,6,4,9,3,8,12,7,11,15,13,14/E:(14,15)/rA:15nCCCCCCFCCCNCOOO/rB:s1;d2;s3;d4;d1s5;s6;s4;d8;s9;s3d10;s9;d12;s12;s8;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H6FNO3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:4.89317
Area:344.751
Solvation:-3.72562
Coulombic:-50.6295
Bond Count [?]
All:16
Single:10
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:207.158
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.69
LogP (Chemaxon):0.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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