Chemical ID: 5871745

c1cc2c(cc1F)c(=O)c(c[nH]2)C(=O)O
Chemical ID:
5871745
Name [?]:
6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid
SMILES [?]:
c1cc2c(cc1F)c(=O)c(c[nH]2)C(=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:1,2,5,11,6,4,10,3,8,13,7,12,9,14,15/E:(14,15)/rA:15nCCCCCCFCOCCNCOO/rB:s1;d2;s3;d4;d1s5;s6;s4;d8;s8;d10;s3s11;s10;d13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H6FNO3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:4.79905
Area:346.189
Solvation:-3.85568
Coulombic:-48.5641
Bond Count [?]
All:16
Single:10
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:207.158
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.48
LogP (Chemaxon):1.65

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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