Chemical ID: 6915617

c1cncc(c1O)O
Chemical ID:
6915617
Name [?]:
pyridine-3,4-diol
SMILES [?]:
c1cncc(c1O)O
InChi [?]:
InChI=1/C5H5NO2/c7-4-1-2-6-3-5(4)8/h1-3,8H,(H,6,7)
InChi Info:
AuxInfo=1/1/N:1,2,4,6,5,3,7,8/rA:8nCCNCCCOO/rB:s1;d2;s3;d4;d1s5;s6;s5;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C5H5NO2
All Atoms:13
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:3.23122
Area:248.343
Solvation:-2.97736
Coulombic:-36.3351
Bond Count [?]
All:8
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:111.099
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:0.39
LogP (Chemaxon):-0.1

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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