Chemical ID: 6681451

c1ccc2c(c1)c(cc(n2)O)[O-]
Chemical ID:
6681451
Name [?]:
2-hydroxyquinolin-4-olate
SMILES [?]:
c1ccc2c(c1)c(cc(n2)O)[O-]
InChi [?]:
InChI=1/C9H7NO2/c11-8-5-9(12)10-7-4-2-1-3-6(7)8/h1-5H,(H2,10,11,12)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,6,3,8,5,4,7,9,10,12,11/rA:12nCCCCCCCCCNOO-/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s9;s7;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H6NO2-
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:-34.5818
Area:308.307
Solvation:-42.2895
Coulombic:-8.97238
Bond Count [?]
All:13
Single:8
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:160.149
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.04
LogP (Chemaxon):2.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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