Chemical ID: 6421453

c1cncc(c1O)C(=O)[O-]
Chemical ID:
6421453
Name [?]:
4-hydroxypyridine-3-carboxylate
SMILES [?]:
c1cncc(c1O)C(=O)[O-]
InChi [?]:
InChI=1/C6H5NO3/c8-5-1-2-7-3-4(5)6(9)10/h1-3H,(H,7,8)(H,9,10)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,4,5,6,8,3,7,9,10/E:(9,10)/rA:10nCCNCCCOCOO-/rB:s1;d2;s3;d4;d1s5;s6;s5;d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H4NO3-
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:-36.6025
Area:277.956
Solvation:-43.5514
Coulombic:-19.5724
Bond Count [?]
All:10
Single:6
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:138.101
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.14
LogP (Chemaxon):-0.74

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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